N-(2-methoxy-5-methyl-phenyl)-2-[2-(1-methylbenzimidazol-2-yl)sulfanylethanoylamino]ethanamide

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-2-[2-(1-methylbenzimidazol-2-yl)sulfanylethanoylamino]ethanamide Openeye Name: N-(2-methoxy-5-methyl-phenyl)-2-[[2-(1-methylbenzimidazol-2-yl)sulfanylacetyl]amino]acetamide CAS Name: N-(2-methoxy-5-methylphenyl)-2-[[2-[(1-methyl-2-benzimidazolyl)thio]-1-oxoethyl]amino]acetamide IUPAC Name: N-(2-methoxy-5-methylphenyl)-2-[[2-(1-methylbenzimidazol-2-yl)sulfanylacetyl]amino]acetamide Traditional Name: N-(2-methoxy-5-methyl-phenyl)-2-[[2-[(1-methylbenzimidazol-2-yl)thio]acetyl]amino]acetamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)CNC(=O)CSC2=NC3=CC=CC=C3N2C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)CNC(=O)CSC2=NC3=CC=CC=C3N2C

InChI

InChI=1S/C20H22N4O3S/c1-13-8-9-17(27-3)15(10-13)22-18(25)11-21-19(26)12-28-20-23-14-6-4-5-7-16(14)24(20)2/h4-10H,11-12H2,1-3H3,(H,21,26)(H,22,25)