N-[4-[(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxidanylidene-propyl]sulfanylphenyl]ethanamide

Systemtic Name: N-[4-[(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxidanylidene-propyl]sulfanylphenyl]ethanamide Openeye Name: N-[4-[(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxo-propyl]sulfanylphenyl]acetamide CAS Name: N-[4-[[(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxopropyl]thio]phenyl]acetamide IUPAC Name: N-[4-[(3E)-3-cyano-3-(3-methyl-1H-benzimidazol-2-ylidene)-2-oxopropyl]sulfanylphenyl]acetamide Traditional Name: N-[4-[[(3E)-3-cyano-2-keto-3-(3-methyl-1H-benzimidazol-2-ylidene)propyl]thio]phenyl]acetamide Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SCC(=O)C(=C2NC3=CC=CC=C3N2C)C#N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SCC(=O)/C(=C/2\NC3=CC=CC=C3N2C)/C#N

InChI

InChI=1S/C20H18N4O2S/c1-13(25)22-14-7-9-15(10-8-14)27-12-19(26)16(11-21)20-23-17-5-3-4-6-18(17)24(20)2/h3-10,23H,12H2,1-2H3,(H,22,25)/b20-16+