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2-[1H-benzimidazol-2-ylsulfanyl(diphenyl)methyl]butanedioic acid

2-[1H-benzimidazol-2-ylsulfanyl(diphenyl)methyl]butanedioic acid

Systemtic Name:2-[1H-benzimidazol-2-ylsulfanyl(diphenyl)methyl]butanedioic acid
Openeye Name:2-[1H-benzimidazol-2-ylsulfanyl(diphenyl)methyl]butanedioic acid
CAS Name:2-[(1H-benzimidazol-2-ylthio)-diphenylmethyl]butanedioic acid
IUPAC Name:2-[1H-benzimidazol-2-ylsulfanyl(diphenyl)methyl]butanedioic acid
Traditional Name:2-[(1H-benzimidazol-2-ylthio)-diphenyl-methyl]succinic acid
Formula: C24H20N2O4S
MolecularWeight: 432.4916
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(CC(=O)O)C(=O)O)SC3=NC4=CC=CC=C4N3


Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(CC(=O)O)C(=O)O)SC3=NC4=CC=CC=C4N3


InChI

InChI=1S/C24H20N2O4S/c27-21(28)15-18(22(29)30)24(16-9-3-1-4-10-16,17-11-5-2-6-12-17)31-23-25-19-13-7-8-14-20(19)26-23/h1-14,18H,15H2,(H,25,26)(H,27,28)(H,29,30)


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