N-[2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanylethanoyl]-4-methoxy-benzamide

Systemtic Name: N-[2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanylethanoyl]-4-methoxy-benzamide Openeye Name: N-[2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanylacetyl]-4-methoxy-benzamide CAS Name: N-[2-[[1-(2-cyanoethyl)-2-benzimidazolyl]thio]-1-oxoethyl]-4-methoxybenzamide IUPAC Name: N-[2-[1-(2-cyanoethyl)benzimidazol-2-yl]sulfanylacetyl]-4-methoxybenzamide Traditional Name: N-[2-[[1-(2-cyanoethyl)benzimidazol-2-yl]thio]acetyl]-4-methoxy-benzamide Formula: C20H18N4O3S MolecularWeight: 394.44692

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(=O)CSC2=NC3=CC=CC=C3N2CCC#N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC(=O)CSC2=NC3=CC=CC=C3N2CCC#N

InChI

InChI=1S/C20H18N4O3S/c1-27-15-9-7-14(8-10-15)19(26)23-18(25)13-28-20-22-16-5-2-3-6-17(16)24(20)12-4-11-21/h2-3,5-10H,4,12-13H2,1H3,(H,23,25,26)