N-(2-aminophenyl)-4-[(6-cyano-2-sulfanylidene-3H-benzimidazol-1-yl)methyl]benzamide

Systemtic Name: N-(2-aminophenyl)-4-[(6-cyano-2-sulfanylidene-3H-benzimidazol-1-yl)methyl]benzamide Openeye Name: N-(2-aminophenyl)-4-[(6-cyano-2-thioxo-3H-benzimidazol-1-yl)methyl]benzamide CAS Name: N-(2-aminophenyl)-4-[(6-cyano-2-sulfanylidene-3H-benzimidazol-1-yl)methyl]benzamide IUPAC Name: N-(2-aminophenyl)-4-[(6-cyano-2-sulfanylidene-3H-benzimidazol-1-yl)methyl]benzamide Traditional Name: N-(2-aminophenyl)-4-[(6-cyano-2-thioxo-3H-benzimidazol-1-yl)methyl]benzamide Formula: C22H17N5OS MolecularWeight: 399.46828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N)NC(=O)C2=CC=C(C=C2)CN3C4=C(C=CC(=C4)C#N)NC3=S

Isomeric SMILES

C1=CC=C(C(=C1)N)NC(=O)C2=CC=C(C=C2)CN3C4=C(C=CC(=C4)C#N)NC3=S

InChI

InChI=1S/C22H17N5OS/c23-12-15-7-10-19-20(11-15)27(22(29)26-19)13-14-5-8-16(9-6-14)21(28)25-18-4-2-1-3-17(18)24/h1-11H,13,24H2,(H,25,28)(H,26,29)