butyl 2-[5-methoxy-1-(phenylmethyl)benzimidazol-2-yl]sulfanylethanoate

Systemtic Name: butyl 2-[5-methoxy-1-(phenylmethyl)benzimidazol-2-yl]sulfanylethanoate Openeye Name: butyl 2-(1-benzyl-5-methoxy-benzimidazol-2-yl)sulfanylacetate CAS Name: 2-[[5-methoxy-1-(phenylmethyl)-2-benzimidazolyl]thio]acetic acid butyl ester IUPAC Name: butyl 2-(1-benzyl-5-methoxybenzimidazol-2-yl)sulfanylacetate Traditional Name: 2-[(1-benzyl-5-methoxy-benzimidazol-2-yl)thio]acetic acid butyl ester Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CSC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)OC

Isomeric SMILES

CCCCOC(=O)CSC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)OC

InChI

InChI=1S/C21H24N2O3S/c1-3-4-12-26-20(24)15-27-21-22-18-13-17(25-2)10-11-19(18)23(21)14-16-8-6-5-7-9-16/h5-11,13H,3-4,12,14-15H2,1-2H3