About 2-cyclopropyl-2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylacetamide;2-[[4-[difluoro(phenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-2-fluoro-N-phenylacetamide;1-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylcyclopentane-1-carboxamide;2-[[4-[(4-fluorophenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide
2-cyclopropyl-2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylacetamide;2-[[4-[difluoro(phenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-2-fluoro-N-phenylacetamide;1-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylcyclopentane-1-carboxamide;2-[[4-[(4-fluorophenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide (PubChem CID 159516412) has the molecular formula C165H155F4N33O8S16
and a molecular weight of 3317.34 g/mol. Its IUPAC name is 2-cyclopropyl-2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylacetamide;2-[[4-[difluoro(phenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-2-fluoro-N-phenylacetamide;1-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylcyclopentane-1-carboxamide;2-[[4-[(4-fluorophenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide.
Frequently Asked Questions
What is the IUPAC name of 2-cyclopropyl-2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylacetamide;2-[[4-[difluoro(phenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-2-fluoro-N-phenylacetamide;1-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylcyclopentane-1-carboxamide;2-[[4-[(4-fluorophenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide?
The IUPAC name of 2-cyclopropyl-2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylacetamide;2-[[4-[difluoro(phenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-2-fluoro-N-phenylacetamide;1-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylcyclopentane-1-carboxamide;2-[[4-[(4-fluorophenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide (CID 159516412) is 2-cyclopropyl-2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylacetamide;2-[[4-[difluoro(phenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-2-fluoro-N-phenylacetamide;1-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylcyclopentane-1-carboxamide;2-[[4-[(4-fluorophenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide.
What is the SMILES notation for 2-cyclopropyl-2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylacetamide;2-[[4-[difluoro(phenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-2-fluoro-N-phenylacetamide;1-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylcyclopentane-1-carboxamide;2-[[4-[(4-fluorophenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide?
The canonical SMILES for 2-cyclopropyl-2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylacetamide;2-[[4-[difluoro(phenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-2-fluoro-N-phenylacetamide;1-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylcyclopentane-1-carboxamide;2-[[4-[(4-fluorophenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide is CC(Sc1nnc(-c2ccsc2)n1C(C)c1ccccc1)C(=O)Nc1ccccc1.CC(c1ccccc1)n1c(SCC(=O)Nc2ccccc2)nnc1-c1ccsc1.CCn1c(SC(C(=O)Nc2ccccc2)C2CC2)nnc1-c1ccsc1.CCn1c(SC(F)C(=O)Nc2ccccc2)nnc1-c1ccsc1.CCn1c(SC2(C(=O)Nc3ccccc3)CCCC2)nnc1-c1ccsc1.CN(C)c1ccc(Cn2c(SCC(=O)Nc3ccccc3)nnc2-c2ccsc2)cc1.O=C(CSc1nnc(-c2ccsc2)n1C(F)(F)c1ccccc1)Nc1ccccc1.O=C(CSc1nnc(-c2ccsc2)n1Cc1ccc(F)cc1)Nc1ccccc1.
What is the InChIKey of 2-cyclopropyl-2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylacetamide;2-[[4-[difluoro(phenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-2-fluoro-N-phenylacetamide;1-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylcyclopentane-1-carboxamide;2-[[4-[(4-fluorophenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide?
The InChIKey is MBGFSFPKBOPBMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N5OS2.C23H22N4OS2.C22H20N4OS2.C21H16F2N4OS2.C21H17FN4OS2.C20H22N4OS2.C19H20N4OS2.C16H15FN4OS2/c1-27(2)20-10-8-17(9-11-20)14-28-22(18-12-13-30-15-18)25-26-23(28)31-16-21(29)24-19-6-4-3-5-7-19;1-16(18-9-5-3-6-10-18)27-21(19-13-14-29-15-19)25-26-23(27)30-17(2)22(28)24-20-11-7-4-8-12-20;1-16(17-8-4-2-5-9-17)26-21(18-12-13-28-14-18)24-25-22(26)29-15-20(27)23-19-10-6-3-7-11-19;22-21(23,16-7-3-1-4-8-16)27-19(15-11-12-29-13-15)25-26-20(27)30-14-18(28)24-17-9-5-2-6-10-17;22-17-8-6-15(7-9-17)12-26-20(16-10-11-28-13-16)24-25-21(26)29-14-19(27)23-18-4-2-1-3-5-18;1-2-24-17(15-10-13-26-14-15)22-23-19(24)27-20(11-6-7-12-20)18(25)21-16-8-4-3-5-9-16;1-2-23-17(14-10-11-25-12-14)21-22-19(23)26-16(13-8-9-13)18(24)20-15-6-4-3-5-7-15;1-2-21-14(11-8-9-23-10-11)19-20-16(21)24-13(17)15(22)18-12-6-4-3-5-7-12/h3-13,15H,14,16H2,1-2H3,(H,24,29);3-17H,1-2H3,(H,24,28);2-14,16H,15H2,1H3,(H,23,27);1-13H,14H2,(H,24,28);1-11,13H,12,14H2,(H,23,27);3-5,8-10,13-14H,2,6-7,11-12H2,1H3,(H,21,25);3-7,10-13,16H,2,8-9H2,1H3,(H,20,24);3-10,13H,2H2,1H3,(H,18,22).
What are the key properties of 2-cyclopropyl-2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylacetamide;2-[[4-[difluoro(phenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-2-fluoro-N-phenylacetamide;1-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylcyclopentane-1-carboxamide;2-[[4-[(4-fluorophenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide?
2-cyclopropyl-2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylacetamide;2-[[4-[difluoro(phenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-2-fluoro-N-phenylacetamide;1-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylcyclopentane-1-carboxamide;2-[[4-[(4-fluorophenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide has a molecular weight of 3317.34 g/mol, XLogP of 39.85, 55 rotatable bonds, 8 hydrogen bond donors, and 49 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylacetamide;2-[[4-[difluoro(phenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[[4-[[4-(dimethylamino)phenyl]methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;2-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-2-fluoro-N-phenylacetamide;1-[(4-ethyl-5-thiophen-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylcyclopentane-1-carboxamide;2-[[4-[(4-fluorophenyl)methyl]-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide;N-phenyl-2-[[4-(1-phenylethyl)-5-thiophen-3-yl-1,2,4-triazol-3-yl]sulfanyl]propanamide is sourced from PubChem (CID 159516412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).