2-(9,10-dinaphthalen-2-ylanthracen-2-yl)-5-[5-(2,2-diphenylethenyl)thiophen-2-yl]thiophene;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzothiazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzoxazole;2-[[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]methylidene]propanedinitrile;2-[5-[5-(9,10-dinaphthalen-1-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole

C310H188N8OS13 — CID 161469664

IUPAC2-(9,10-dinaphthalen-2-ylanthracen-2-yl)-5-[5-(2,2-diphenylethenyl)thiophen-2-yl]thiophene;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzothiazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzoxazole;2-[[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]methylidene]propanedinitrile;2-[5-[5-(9,10-dinaphthalen-1-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole
SMILESC(=C(c1ccccc1)c1ccccc1)c1ccc(-c2ccc(-c3ccc4c(-c5ccc6ccccc6c5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)s2)s1.N#CC(C#N)=Cc1ccc(-c2ccc(-c3ccc4c(-c5ccc6ccccc6c5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)s2)s1.c1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc6c(-c7ccc8ccccc8c7)c7ccccc7c(-c7ccc8ccccc8c7)c6c5)s4)s3)nc3ccccc32)cc1.c1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc6c(-c7cccc8ccccc78)c7ccccc7c(-c7cccc8ccccc78)c6c5)s4)s3)nc3ccccc32)cc1.c1ccc2cc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4cc(-c5ccc(-c6ccc(-c7nc8ccccc8o7)s6)s5)ccc34)ccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4cc(-c5ccc(-c6ccc(-c7nc8ccccc8s7)s6)s5)ccc34)ccc2c1
InChIInChI=1S/C56H36S2.2C55H34N2S2.C49H29NOS2.C49H29NS3.C46H26N2S2/c1-3-15-39(16-4-1)50(40-17-5-2-6-18-40)36-46-28-30-53(57-46)54-32-31-52(58-54)43-27-29-49-51(35-43)56(45-26-24-38-14-8-10-20-42(38)34-45)48-22-12-11-21-47(48)55(49)44-25-23-37-13-7-9-19-41(37)33-44;1-2-18-38(19-3-1)57-48-27-11-10-26-47(48)56-55(57)52-33-32-51(59-52)50-31-30-49(58-50)37-28-29-45-46(34-37)54(42-25-13-17-36-15-5-7-21-40(36)42)44-23-9-8-22-43(44)53(45)41-24-12-16-35-14-4-6-20-39(35)41;1-2-16-42(17-3-1)57-48-21-11-10-20-47(48)56-55(57)52-31-30-51(59-52)50-29-28-49(58-50)39-26-27-45-46(34-39)54(41-25-23-36-13-5-7-15-38(36)33-41)44-19-9-8-18-43(44)53(45)40-24-22-35-12-4-6-14-37(35)32-40;1-3-11-32-27-35(19-17-30(32)9-1)47-37-13-5-6-14-38(37)48(36-20-18-31-10-2-4-12-33(31)28-36)40-29-34(21-22-39(40)47)43-23-24-44(52-43)45-25-26-46(53-45)49-50-41-15-7-8-16-42(41)51-49;1-3-11-32-27-35(19-17-30(32)9-1)47-37-13-5-6-14-38(37)48(36-20-18-31-10-2-4-12-33(31)28-36)40-29-34(21-22-39(40)47)42-23-24-44(51-42)45-25-26-46(52-45)49-50-41-15-7-8-16-43(41)53-49;47-27-29(28-48)23-37-18-20-43(49-37)44-22-21-42(50-44)34-17-19-40-41(26-34)46(36-16-14-31-8-2-4-10-33(31)25-36)39-12-6-5-11-38(39)45(40)35-15-13-30-7-1-3-9-32(30)24-35/h1-36H;2*1-34H;2*1-29H;1-26H
InChIKeyWCXFFOUTXFKERY-UHFFFAOYSA-N
MW4457.84 g/mol
LogP92.66
Rot. Bonds34

About 2-(9,10-dinaphthalen-2-ylanthracen-2-yl)-5-[5-(2,2-diphenylethenyl)thiophen-2-yl]thiophene;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzothiazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzoxazole;2-[[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]methylidene]propanedinitrile;2-[5-[5-(9,10-dinaphthalen-1-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole

2-(9,10-dinaphthalen-2-ylanthracen-2-yl)-5-[5-(2,2-diphenylethenyl)thiophen-2-yl]thiophene;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzothiazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzoxazole;2-[[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]methylidene]propanedinitrile;2-[5-[5-(9,10-dinaphthalen-1-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole (PubChem CID 161469664) has the molecular formula C310H188N8OS13 and a molecular weight of 4457.84 g/mol. Its IUPAC name is 2-(9,10-dinaphthalen-2-ylanthracen-2-yl)-5-[5-(2,2-diphenylethenyl)thiophen-2-yl]thiophene;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzothiazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzoxazole;2-[[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]methylidene]propanedinitrile;2-[5-[5-(9,10-dinaphthalen-1-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole.

Molecular Properties

Compound Name2-(9,10-dinaphthalen-2-ylanthracen-2-yl)-5-[5-(2,2-diphenylethenyl)thiophen-2-yl]thiophene;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzothiazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzoxazole;2-[[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]methylidene]propanedinitrile;2-[5-[5-(9,10-dinaphthalen-1-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole
PubChem CID161469664
Molecular FormulaC310H188N8OS13
Molecular Weight4457.84 g/mol
Exact Mass4453.13
IUPAC Name2-(9,10-dinaphthalen-2-ylanthracen-2-yl)-5-[5-(2,2-diphenylethenyl)thiophen-2-yl]thiophene;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzothiazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzoxazole;2-[[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]methylidene]propanedinitrile;2-[5-[5-(9,10-dinaphthalen-1-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole
SMILESC(=C(c1ccccc1)c1ccccc1)c1ccc(-c2ccc(-c3ccc4c(-c5ccc6ccccc6c5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)s2)s1.N#CC(C#N)=Cc1ccc(-c2ccc(-c3ccc4c(-c5ccc6ccccc6c5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)s2)s1.c1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc6c(-c7ccc8ccccc8c7)c7ccccc7c(-c7ccc8ccccc8c7)c6c5)s4)s3)nc3ccccc32)cc1.c1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc6c(-c7cccc8ccccc78)c7ccccc7c(-c7cccc8ccccc78)c6c5)s4)s3)nc3ccccc32)cc1.c1ccc2cc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4cc(-c5ccc(-c6ccc(-c7nc8ccccc8o7)s6)s5)ccc34)ccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4cc(-c5ccc(-c6ccc(-c7nc8ccccc8s7)s6)s5)ccc34)ccc2c1
InChIInChI=1S/C56H36S2.2C55H34N2S2.C49H29NOS2.C49H29NS3.C46H26N2S2/c1-3-15-39(16-4-1)50(40-17-5-2-6-18-40)36-46-28-30-53(57-46)54-32-31-52(58-54)43-27-29-49-51(35-43)56(45-26-24-38-14-8-10-20-42(38)34-45)48-22-12-11-21-47(48)55(49)44-25-23-37-13-7-9-19-41(37)33-44;1-2-18-38(19-3-1)57-48-27-11-10-26-47(48)56-55(57)52-33-32-51(59-52)50-31-30-49(58-50)37-28-29-45-46(34-37)54(42-25-13-17-36-15-5-7-21-40(36)42)44-23-9-8-22-43(44)53(45)41-24-12-16-35-14-4-6-20-39(35)41;1-2-16-42(17-3-1)57-48-21-11-10-20-47(48)56-55(57)52-31-30-51(59-52)50-29-28-49(58-50)39-26-27-45-46(34-39)54(41-25-23-36-13-5-7-15-38(36)33-41)44-19-9-8-18-43(44)53(45)40-24-22-35-12-4-6-14-37(35)32-40;1-3-11-32-27-35(19-17-30(32)9-1)47-37-13-5-6-14-38(37)48(36-20-18-31-10-2-4-12-33(31)28-36)40-29-34(21-22-39(40)47)43-23-24-44(52-43)45-25-26-46(53-45)49-50-41-15-7-8-16-42(41)51-49;1-3-11-32-27-35(19-17-30(32)9-1)47-37-13-5-6-14-38(37)48(36-20-18-31-10-2-4-12-33(31)28-36)40-29-34(21-22-39(40)47)42-23-24-44(51-42)45-25-26-46(52-45)49-50-41-15-7-8-16-43(41)53-49;47-27-29(28-48)23-37-18-20-43(49-37)44-22-21-42(50-44)34-17-19-40-41(26-34)46(36-16-14-31-8-2-4-10-33(31)25-36)39-12-6-5-11-38(39)45(40)35-15-13-30-7-1-3-9-32(30)24-35/h1-36H;2*1-34H;2*1-29H;1-26H
InChIKeyWCXFFOUTXFKERY-UHFFFAOYSA-N
XLogP92.66
TPSA122.14 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds34
Heavy Atoms332
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004457.84
LogP ≤ 592.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Analyze 2-(9,10-dinaphthalen-2-ylanthracen-2-yl)-5-[5-(2,2-diphenylethenyl)thiophen-2-yl]thiophene;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzothiazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzoxazole;2-[[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]methylidene]propanedinitrile;2-[5-[5-(9,10-dinaphthalen-1-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole with MolForge

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Related Compounds

2-[4-(10-naphthalen-1-yl-9-naphthalen-2-ylanthracen-2-yl)naphthalen-1-yl]-1-phenylbenzimidazole
CID 118604213
2-[6-(1,3-benzothiazol-2-yl)-9-[4-(1-phenylbenzimidazol-2-yl)phenyl]carbazol-3-yl]-6-naphthalen-2-yl-1,3-benzoxazole;2-[6-(1,3-benzothiazol-2-yl)-9-[4-(1-phenylbenzimidazol-2-yl)phenyl]carbazol-3-yl]-6-phenyl-1,3-benzoxazole;2-[6-(1,3-benzoxazol-2-yl)-9-[4-(1-phenylbenzimidazol-2-yl)phenyl]carbazol-3-yl]-1,3-benzoxazole
CID 160563783
4-(benzimidazolo[1,2-c]quinazolin-6-yl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaene;4-(4-carbazol-9-ylphenyl)-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaene;2-[4-[4-(14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-4-yl)phenyl]phenyl]-1,3-benzoxazole;4-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaene;4-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaene;4-[4-(5-phenylthiophen-2-yl)phenyl]-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaene
CID 157454913
2-[4-[9,10-bis(2-phenylphenyl)anthracen-2-yl]phenyl]-1-phenylbenzimidazole;2-[4-(9,10-dinaphthalen-1-ylanthracen-2-yl)phenyl]-1-phenylbenzimidazole;2-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-1-phenylbenzimidazole;2-[4-(9,10-diphenylanthracen-2-yl)phenyl]-1-phenylbenzimidazole
CID 159805058
2-[4-(10-naphthalen-1-ylanthracen-9-yl)phenyl]-1,3-benzoxazole;2-[4-(10-naphthalen-2-ylanthracen-9-yl)phenyl]-1,3-benzoxazole
CID 159053845
2-[9-naphthalen-2-yl-10-[4-(1-phenylbenzimidazol-2-yl)phenyl]anthracen-2-yl]benzene-1,3-diol
CID 90380743
2-[6-(1,3-benzothiazol-2-yl)-9-(1-phenylbenzimidazol-2-yl)carbazol-3-yl]-6-naphthalen-2-yl-1,3-benzoxazole;2-[6-(1,3-benzoxazol-2-yl)-9-[4-[4-methyl-2,6-bis(trideuteriomethyl)phenyl]phenyl]carbazol-3-yl]-1,3-benzoxazole;2-[6-(1,3-benzoxazol-2-yl)-9-[4-(2,4,6-trimethylphenyl)phenyl]carbazol-3-yl]-1,3-benzoxazole
CID 159372469
2-[10-[3-(1,3-benzothiazol-2-yl)-5-(1,10-phenanthrolin-5-yl)phenyl]anthracen-9-yl]-1,3-benzoxazole;2-[3-naphthalen-1-yl-5-[10-(1-phenylbenzimidazol-2-yl)anthracen-9-yl]phenyl]-1,3-benzoxazole;1-phenyl-2-[2-pyren-1-yl-6-(3-pyridin-4-ylphenyl)pyrimidin-4-yl]benzimidazole
CID 157499048
2-[4-(6,10-diphenylphenanthridin-3-yl)phenyl]-1,3-benzothiazole;2-[4-(6,10-diphenylphenanthridin-3-yl)phenyl]-1,3-benzoxazole;6,10-diphenyl-3-[4-(1-phenylbenzimidazol-2-yl)phenyl]phenanthridine;methane
CID 159000306
2-[6-(9,10-dinaphthalen-2-ylanthracen-2-yl)naphthalen-2-yl]-1-phenylbenzimidazole;2-[7-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenanthren-2-yl]-1-phenylbenzimidazole
CID 158004452
2-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]-1-phenylbenzimidazole;methane
CID 159933758
2-[6-[10-[4-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]anthracen-9-yl]naphthalen-2-yl]-1-phenylbenzimidazole
CID 58963543

Frequently Asked Questions

What is the IUPAC name of 2-(9,10-dinaphthalen-2-ylanthracen-2-yl)-5-[5-(2,2-diphenylethenyl)thiophen-2-yl]thiophene;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzothiazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzoxazole;2-[[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]methylidene]propanedinitrile;2-[5-[5-(9,10-dinaphthalen-1-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole?
The IUPAC name of 2-(9,10-dinaphthalen-2-ylanthracen-2-yl)-5-[5-(2,2-diphenylethenyl)thiophen-2-yl]thiophene;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzothiazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzoxazole;2-[[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]methylidene]propanedinitrile;2-[5-[5-(9,10-dinaphthalen-1-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole (CID 161469664) is 2-(9,10-dinaphthalen-2-ylanthracen-2-yl)-5-[5-(2,2-diphenylethenyl)thiophen-2-yl]thiophene;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzothiazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzoxazole;2-[[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]methylidene]propanedinitrile;2-[5-[5-(9,10-dinaphthalen-1-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole.
What is the SMILES notation for 2-(9,10-dinaphthalen-2-ylanthracen-2-yl)-5-[5-(2,2-diphenylethenyl)thiophen-2-yl]thiophene;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzothiazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzoxazole;2-[[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]methylidene]propanedinitrile;2-[5-[5-(9,10-dinaphthalen-1-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole?
The canonical SMILES for 2-(9,10-dinaphthalen-2-ylanthracen-2-yl)-5-[5-(2,2-diphenylethenyl)thiophen-2-yl]thiophene;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzothiazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzoxazole;2-[[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]methylidene]propanedinitrile;2-[5-[5-(9,10-dinaphthalen-1-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole is C(=C(c1ccccc1)c1ccccc1)c1ccc(-c2ccc(-c3ccc4c(-c5ccc6ccccc6c5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)s2)s1.N#CC(C#N)=Cc1ccc(-c2ccc(-c3ccc4c(-c5ccc6ccccc6c5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)s2)s1.c1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc6c(-c7ccc8ccccc8c7)c7ccccc7c(-c7ccc8ccccc8c7)c6c5)s4)s3)nc3ccccc32)cc1.c1ccc(-n2c(-c3ccc(-c4ccc(-c5ccc6c(-c7cccc8ccccc78)c7ccccc7c(-c7cccc8ccccc78)c6c5)s4)s3)nc3ccccc32)cc1.c1ccc2cc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4cc(-c5ccc(-c6ccc(-c7nc8ccccc8o7)s6)s5)ccc34)ccc2c1.c1ccc2cc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4cc(-c5ccc(-c6ccc(-c7nc8ccccc8s7)s6)s5)ccc34)ccc2c1.
What is the InChIKey of 2-(9,10-dinaphthalen-2-ylanthracen-2-yl)-5-[5-(2,2-diphenylethenyl)thiophen-2-yl]thiophene;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzothiazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzoxazole;2-[[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]methylidene]propanedinitrile;2-[5-[5-(9,10-dinaphthalen-1-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole?
The InChIKey is WCXFFOUTXFKERY-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H36S2.2C55H34N2S2.C49H29NOS2.C49H29NS3.C46H26N2S2/c1-3-15-39(16-4-1)50(40-17-5-2-6-18-40)36-46-28-30-53(57-46)54-32-31-52(58-54)43-27-29-49-51(35-43)56(45-26-24-38-14-8-10-20-42(38)34-45)48-22-12-11-21-47(48)55(49)44-25-23-37-13-7-9-19-41(37)33-44;1-2-18-38(19-3-1)57-48-27-11-10-26-47(48)56-55(57)52-33-32-51(59-52)50-31-30-49(58-50)37-28-29-45-46(34-37)54(42-25-13-17-36-15-5-7-21-40(36)42)44-23-9-8-22-43(44)53(45)41-24-12-16-35-14-4-6-20-39(35)41;1-2-16-42(17-3-1)57-48-21-11-10-20-47(48)56-55(57)52-31-30-51(59-52)50-29-28-49(58-50)39-26-27-45-46(34-39)54(41-25-23-36-13-5-7-15-38(36)33-41)44-19-9-8-18-43(44)53(45)40-24-22-35-12-4-6-14-37(35)32-40;1-3-11-32-27-35(19-17-30(32)9-1)47-37-13-5-6-14-38(37)48(36-20-18-31-10-2-4-12-33(31)28-36)40-29-34(21-22-39(40)47)43-23-24-44(52-43)45-25-26-46(53-45)49-50-41-15-7-8-16-42(41)51-49;1-3-11-32-27-35(19-17-30(32)9-1)47-37-13-5-6-14-38(37)48(36-20-18-31-10-2-4-12-33(31)28-36)40-29-34(21-22-39(40)47)42-23-24-44(51-42)45-25-26-46(52-45)49-50-41-15-7-8-16-43(41)53-49;47-27-29(28-48)23-37-18-20-43(49-37)44-22-21-42(50-44)34-17-19-40-41(26-34)46(36-16-14-31-8-2-4-10-33(31)25-36)39-12-6-5-11-38(39)45(40)35-15-13-30-7-1-3-9-32(30)24-35/h1-36H;2*1-34H;2*1-29H;1-26H.
What are the key properties of 2-(9,10-dinaphthalen-2-ylanthracen-2-yl)-5-[5-(2,2-diphenylethenyl)thiophen-2-yl]thiophene;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzothiazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzoxazole;2-[[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]methylidene]propanedinitrile;2-[5-[5-(9,10-dinaphthalen-1-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole?
2-(9,10-dinaphthalen-2-ylanthracen-2-yl)-5-[5-(2,2-diphenylethenyl)thiophen-2-yl]thiophene;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzothiazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzoxazole;2-[[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]methylidene]propanedinitrile;2-[5-[5-(9,10-dinaphthalen-1-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole has a molecular weight of 4457.84 g/mol, XLogP of 92.66, 34 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(9,10-dinaphthalen-2-ylanthracen-2-yl)-5-[5-(2,2-diphenylethenyl)thiophen-2-yl]thiophene;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzothiazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3-benzoxazole;2-[[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]methylidene]propanedinitrile;2-[5-[5-(9,10-dinaphthalen-1-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole;2-[5-[5-(9,10-dinaphthalen-2-ylanthracen-2-yl)thiophen-2-yl]thiophen-2-yl]-1-phenylbenzimidazole is sourced from PubChem (CID 161469664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).