2-[[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxidanylidene-propyl]-methyl-amino]-N-(2-methylsulfanylphenyl)ethanamide

Systemtic Name: 2-[[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxidanylidene-propyl]-methyl-amino]-N-(2-methylsulfanylphenyl)ethanamide Openeye Name: 2-[[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxo-propyl]-methyl-amino]-N-(2-methylsulfanylphenyl)acetamide CAS Name: 2-[[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxopropyl]-methylamino]-N-[2-(methylthio)phenyl]acetamide IUPAC Name: 2-[[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxopropyl]-methylamino]-N-(2-methylsulfanylphenyl)acetamide Traditional Name: 2-[[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-keto-propyl]-methyl-amino]-N-[2-(methylthio)phenyl]acetamide Formula: C21H21N5O2S MolecularWeight: 407.48874

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)C(=C1NC2=CC=CC=C2N1)C#N)CC(=O)NC3=CC=CC=C3SC

Isomeric SMILES

CN(CC(=O)C(=C1NC2=CC=CC=C2N1)C#N)CC(=O)NC3=CC=CC=C3SC

InChI

InChI=1S/C21H21N5O2S/c1-26(13-20(28)23-17-9-5-6-10-19(17)29-2)12-18(27)14(11-22)21-24-15-7-3-4-8-16(15)25-21/h3-10,24-25H,12-13H2,1-2H3,(H,23,28)