4-[1-[(4-chloranyl-1-methyl-indol-3-yl)methyl]-5,6-dimethyl-benzimidazol-2-yl]sulfanylbutanoic acid

Systemtic Name: 4-[1-[(4-chloranyl-1-methyl-indol-3-yl)methyl]-5,6-dimethyl-benzimidazol-2-yl]sulfanylbutanoic acid Openeye Name: 4-[1-[(4-chloro-1-methyl-indol-3-yl)methyl]-5,6-dimethyl-benzimidazol-2-yl]sulfanylbutanoic acid CAS Name: 4-[[1-[(4-chloro-1-methyl-3-indolyl)methyl]-5,6-dimethyl-2-benzimidazolyl]thio]butanoic acid IUPAC Name: 4-[1-[(4-chloro-1-methylindol-3-yl)methyl]-5,6-dimethylbenzimidazol-2-yl]sulfanylbutanoic acid Traditional Name: 4-[[1-[(4-chloro-1-methyl-indol-3-yl)methyl]-5,6-dimethyl-benzimidazol-2-yl]thio]butyric acid Formula: C23H24ClN3O2S MolecularWeight: 441.97356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)SCCCC(=O)O)CC3=CN(C4=C3C(=CC=C4)Cl)C

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)SCCCC(=O)O)CC3=CN(C4=C3C(=CC=C4)Cl)C

InChI

InChI=1S/C23H24ClN3O2S/c1-14-10-18-20(11-15(14)2)27(23(25-18)30-9-5-8-21(28)29)13-16-12-26(3)19-7-4-6-17(24)22(16)19/h4,6-7,10-12H,5,8-9,13H2,1-3H3,(H,28,29)