propan-2-yl 4-[[2-(phenylmethylsulfanyl)benzimidazol-1-yl]methyl]benzoate

Systemtic Name: propan-2-yl 4-[[2-(phenylmethylsulfanyl)benzimidazol-1-yl]methyl]benzoate Openeye Name: isopropyl 4-[(2-benzylsulfanylbenzimidazol-1-yl)methyl]benzoate CAS Name: 4-[[2-(phenylmethylthio)-1-benzimidazolyl]methyl]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[(2-benzylsulfanylbenzimidazol-1-yl)methyl]benzoate Traditional Name: 4-[[2-(benzylthio)benzimidazol-1-yl]methyl]benzoic acid isopropyl ester Formula: C25H24N2O2S MolecularWeight: 416.53526

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2SCC4=CC=CC=C4

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2SCC4=CC=CC=C4

InChI

InChI=1S/C25H24N2O2S/c1-18(2)29-24(28)21-14-12-19(13-15-21)16-27-23-11-7-6-10-22(23)26-25(27)30-17-20-8-4-3-5-9-20/h3-15,18H,16-17H2,1-2H3