About 2-[[6-(dicyanomethylideneamino)-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]propanedinitrile;2-[2-[[6-[[1-(dicyanomethylidene)-5,6-difluoro-3-oxoinden-2-ylidene]amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-5,6-difluoro-3-oxoinden-1-ylidene]propanedinitrile;2-[[6-[(5,6-difluoro-1,3-dioxoinden-2-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5,6-difluoroindene-1,3-dione;2-[[6-[(1,3-dioxo-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracen-2-ylidene)amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracene-1,3-dione;(3Z)-3-[[6-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]indene-1,2-dione;(3Z)-3-[[6-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione
2-[[6-(dicyanomethylideneamino)-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]propanedinitrile;2-[2-[[6-[[1-(dicyanomethylidene)-5,6-difluoro-3-oxoinden-2-ylidene]amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-5,6-difluoro-3-oxoinden-1-ylidene]propanedinitrile;2-[[6-[(5,6-difluoro-1,3-dioxoinden-2-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5,6-difluoroindene-1,3-dione;2-[[6-[(1,3-dioxo-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracen-2-ylidene)amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracene-1,3-dione;(3Z)-3-[[6-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]indene-1,2-dione;(3Z)-3-[[6-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione (PubChem CID 164952417) has the molecular formula C216H120F14N14O24S24
and a molecular weight of 4330.99 g/mol. Its IUPAC name is 2-[[6-(dicyanomethylideneamino)-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]propanedinitrile;2-[2-[[6-[[1-(dicyanomethylidene)-5,6-difluoro-3-oxoinden-2-ylidene]amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-5,6-difluoro-3-oxoinden-1-ylidene]propanedinitrile;2-[[6-[(5,6-difluoro-1,3-dioxoinden-2-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5,6-difluoroindene-1,3-dione;2-[[6-[(1,3-dioxo-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracen-2-ylidene)amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracene-1,3-dione;(3Z)-3-[[6-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]indene-1,2-dione;(3Z)-3-[[6-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione.
Frequently Asked Questions
What is the IUPAC name of 2-[[6-(dicyanomethylideneamino)-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]propanedinitrile;2-[2-[[6-[[1-(dicyanomethylidene)-5,6-difluoro-3-oxoinden-2-ylidene]amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-5,6-difluoro-3-oxoinden-1-ylidene]propanedinitrile;2-[[6-[(5,6-difluoro-1,3-dioxoinden-2-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5,6-difluoroindene-1,3-dione;2-[[6-[(1,3-dioxo-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracen-2-ylidene)amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracene-1,3-dione;(3Z)-3-[[6-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]indene-1,2-dione;(3Z)-3-[[6-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione?
The IUPAC name of 2-[[6-(dicyanomethylideneamino)-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]propanedinitrile;2-[2-[[6-[[1-(dicyanomethylidene)-5,6-difluoro-3-oxoinden-2-ylidene]amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-5,6-difluoro-3-oxoinden-1-ylidene]propanedinitrile;2-[[6-[(5,6-difluoro-1,3-dioxoinden-2-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5,6-difluoroindene-1,3-dione;2-[[6-[(1,3-dioxo-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracen-2-ylidene)amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracene-1,3-dione;(3Z)-3-[[6-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]indene-1,2-dione;(3Z)-3-[[6-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione (CID 164952417) is 2-[[6-(dicyanomethylideneamino)-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]propanedinitrile;2-[2-[[6-[[1-(dicyanomethylidene)-5,6-difluoro-3-oxoinden-2-ylidene]amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-5,6-difluoro-3-oxoinden-1-ylidene]propanedinitrile;2-[[6-[(5,6-difluoro-1,3-dioxoinden-2-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5,6-difluoroindene-1,3-dione;2-[[6-[(1,3-dioxo-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracen-2-ylidene)amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracene-1,3-dione;(3Z)-3-[[6-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]indene-1,2-dione;(3Z)-3-[[6-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione.
What is the SMILES notation for 2-[[6-(dicyanomethylideneamino)-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]propanedinitrile;2-[2-[[6-[[1-(dicyanomethylidene)-5,6-difluoro-3-oxoinden-2-ylidene]amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-5,6-difluoro-3-oxoinden-1-ylidene]propanedinitrile;2-[[6-[(5,6-difluoro-1,3-dioxoinden-2-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5,6-difluoroindene-1,3-dione;2-[[6-[(1,3-dioxo-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracen-2-ylidene)amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracene-1,3-dione;(3Z)-3-[[6-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]indene-1,2-dione;(3Z)-3-[[6-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione?
The canonical SMILES for 2-[[6-(dicyanomethylideneamino)-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]propanedinitrile;2-[2-[[6-[[1-(dicyanomethylidene)-5,6-difluoro-3-oxoinden-2-ylidene]amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-5,6-difluoro-3-oxoinden-1-ylidene]propanedinitrile;2-[[6-[(5,6-difluoro-1,3-dioxoinden-2-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5,6-difluoroindene-1,3-dione;2-[[6-[(1,3-dioxo-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracen-2-ylidene)amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracene-1,3-dione;(3Z)-3-[[6-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]indene-1,2-dione;(3Z)-3-[[6-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione is CC1(C)Oc2c(sc3cc(/C=C4\C(=O)C(=O)c5ccc(C(F)(F)F)cc54)sc23)-c2sc3cc(/C=C4\C(=O)C(=O)c5ccc(C(F)(F)F)cc54)sc3c21.CC1(C)Oc2c(sc3cc(/C=C4\C(=O)C(=O)c5ccccc54)sc23)-c2sc3cc(/C=C4\C(=O)C(=O)c5ccccc54)sc3c21.CC1(C)Oc2c(sc3cc(C=C4C(=O)c5cc(F)c(F)cc5C4=O)sc23)-c2sc3cc(C=C4C(=O)c5cc(F)c(F)cc5C4=O)sc3c21.CC1(C)Oc2c(sc3cc(N=C(C#N)C#N)sc23)-c2sc3cc(N=C(C#N)C#N)sc3c21.CC1(C)Oc2c(sc3cc(N=C4C(=O)C5CC6CC7CCCCC7CC6CC5C4=O)sc23)-c2sc3cc(N=C4C(=O)C5CC6CC7CCCCC7CC6CC5C4=O)sc3c21.CC1(C)Oc2c(sc3cc(N=C4C(=O)c5cc(F)c(F)cc5C4=C(C#N)C#N)sc23)-c2sc3cc(N=C4C(=O)c5cc(F)c(F)cc5C4=C(C#N)C#N)sc3c21.
What is the InChIKey of 2-[[6-(dicyanomethylideneamino)-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]propanedinitrile;2-[2-[[6-[[1-(dicyanomethylidene)-5,6-difluoro-3-oxoinden-2-ylidene]amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-5,6-difluoro-3-oxoinden-1-ylidene]propanedinitrile;2-[[6-[(5,6-difluoro-1,3-dioxoinden-2-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5,6-difluoroindene-1,3-dione;2-[[6-[(1,3-dioxo-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracen-2-ylidene)amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracene-1,3-dione;(3Z)-3-[[6-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]indene-1,2-dione;(3Z)-3-[[6-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione?
The InChIKey is WARIHXCLMWPWNM-KURALSDASA-N. The full InChI is InChI=1S/C49H52N2O5S4.C39H12F4N6O3S4.C37H16F6O5S4.C35H14F4O5S4.C35H18O5S4.C21H8N6OS4/c1-49(2)37-45-33(19-35(59-45)50-38-40(52)29-15-25-11-21-7-3-4-8-22(21)12-26(25)16-30(29)41(38)53)57-47(37)48-44(56-49)46-34(58-48)20-36(60-46)51-39-42(54)31-17-27-13-23-9-5-6-10-24(23)14-28(27)18-32(31)43(39)55;1-39(2)29-35-23(7-25(55-35)48-30-27(13(9-44)10-45)15-3-19(40)21(42)5-17(15)32(30)50)53-37(29)38-34(52-39)36-24(54-38)8-26(56-36)49-31-28(14(11-46)12-47)16-4-20(41)22(43)6-18(16)33(31)51;1-35(2)25-31-23(11-15(49-31)9-21-19-7-13(36(38,39)40)3-5-17(19)26(44)28(21)46)51-33(25)34-30(48-35)32-24(52-34)12-16(50-32)10-22-20-8-14(37(41,42)43)4-6-18(20)27(45)29(22)47;1-35(2)25-31-23(5-11(45-31)3-17-26(40)13-7-19(36)20(37)8-14(13)27(17)41)47-33(25)34-30(44-35)32-24(48-34)6-12(46-32)4-18-28(42)15-9-21(38)22(39)10-16(15)29(18)43;1-35(2)25-31-23(13-15(41-31)11-21-17-7-3-5-9-19(17)26(36)28(21)38)43-33(25)34-30(40-35)32-24(44-34)14-16(42-32)12-22-18-8-4-6-10-20(18)27(37)29(22)39;1-21(2)15-17-11(3-13(31-17)26-9(5-22)6-23)29-19(15)20-16(28-21)18-12(30-20)4-14(32-18)27-10(7-24)8-25/h19-32H,3-18H2,1-2H3;3-8H,1-2H3;3-12H,1-2H3;3-10H,1-2H3;3-14H,1-2H3;3-4H,1-2H3/b;;21-9-,22-10-;;21-11-,22-12-;.
What are the key properties of 2-[[6-(dicyanomethylideneamino)-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]propanedinitrile;2-[2-[[6-[[1-(dicyanomethylidene)-5,6-difluoro-3-oxoinden-2-ylidene]amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-5,6-difluoro-3-oxoinden-1-ylidene]propanedinitrile;2-[[6-[(5,6-difluoro-1,3-dioxoinden-2-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5,6-difluoroindene-1,3-dione;2-[[6-[(1,3-dioxo-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracen-2-ylidene)amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracene-1,3-dione;(3Z)-3-[[6-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]indene-1,2-dione;(3Z)-3-[[6-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione?
2-[[6-(dicyanomethylideneamino)-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]propanedinitrile;2-[2-[[6-[[1-(dicyanomethylidene)-5,6-difluoro-3-oxoinden-2-ylidene]amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-5,6-difluoro-3-oxoinden-1-ylidene]propanedinitrile;2-[[6-[(5,6-difluoro-1,3-dioxoinden-2-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5,6-difluoroindene-1,3-dione;2-[[6-[(1,3-dioxo-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracen-2-ylidene)amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracene-1,3-dione;(3Z)-3-[[6-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]indene-1,2-dione;(3Z)-3-[[6-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione has a molecular weight of 4330.99 g/mol, XLogP of 60.45, 12 rotatable bonds, 0 hydrogen bond donors, and 62 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-(dicyanomethylideneamino)-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]propanedinitrile;2-[2-[[6-[[1-(dicyanomethylidene)-5,6-difluoro-3-oxoinden-2-ylidene]amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-5,6-difluoro-3-oxoinden-1-ylidene]propanedinitrile;2-[[6-[(5,6-difluoro-1,3-dioxoinden-2-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5,6-difluoroindene-1,3-dione;2-[[6-[(1,3-dioxo-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracen-2-ylidene)amino]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]imino]-3a,4,4a,5,5a,6,7,8,9,9a,10,10a,11,11a-tetradecahydrocyclopenta[b]anthracene-1,3-dione;(3Z)-3-[[6-[(Z)-(2,3-dioxoinden-1-ylidene)methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]indene-1,2-dione;(3Z)-3-[[6-[(Z)-[2,3-dioxo-6-(trifluoromethyl)inden-1-ylidene]methyl]-11,11-dimethyl-10-oxa-3,7,14,18-tetrathiapentacyclo[10.6.0.02,9.04,8.013,17]octadeca-1(12),2(9),4(8),5,13(17),15-hexaen-15-yl]methylidene]-5-(trifluoromethyl)indene-1,2-dione is sourced from PubChem (CID 164952417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).