N-[2-cyano-1-(2-methylsulfanylbenzimidazol-1-yl)propan-2-yl]-4-phenoxy-benzamide

Systemtic Name: N-[2-cyano-1-(2-methylsulfanylbenzimidazol-1-yl)propan-2-yl]-4-phenoxy-benzamide Openeye Name: N-[1-cyano-1-methyl-2-(2-methylsulfanylbenzimidazol-1-yl)ethyl]-4-phenoxy-benzamide CAS Name: N-[2-cyano-1-[2-(methylthio)-1-benzimidazolyl]propan-2-yl]-4-phenoxybenzamide IUPAC Name: N-[2-cyano-1-(2-methylsulfanylbenzimidazol-1-yl)propan-2-yl]-4-phenoxybenzamide Traditional Name: N-[1-cyano-1-methyl-2-[2-(methylthio)benzimidazol-1-yl]ethyl]-4-phenoxy-benzamide Formula: C25H22N4O2S MolecularWeight: 442.53278

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C2=CC=CC=C2N=C1SC)(C#N)NC(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CC(CN1C2=CC=CC=C2N=C1SC)(C#N)NC(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C25H22N4O2S/c1-25(16-26,17-29-22-11-7-6-10-21(22)27-24(29)32-2)28-23(30)18-12-14-20(15-13-18)31-19-8-4-3-5-9-19/h3-15H,17H2,1-2H3,(H,28,30)