N-(4-methyl-2-phenyl-pyrrolo[1,2-a]benzimidazol-1-yl)carbothioylbenzamide

Systemtic Name: N-(4-methyl-2-phenyl-pyrrolo[1,2-a]benzimidazol-1-yl)carbothioylbenzamide Openeye Name: N-(4-methyl-2-phenyl-pyrrolo[1,2-a]benzimidazole-1-carbothioyl)benzamide CAS Name: N-[(4-methyl-2-phenyl-1-pyrrolo[1,2-a]benzimidazolyl)-sulfanylidenemethyl]benzamide IUPAC Name: N-(4-methyl-2-phenylpyrrolo[1,2-a]benzimidazole-1-carbothioyl)benzamide Traditional Name: N-(4-methyl-2-phenyl-pyrrolo[1,2-a]benzimidazole-1-carbothioyl)benzamide Formula: C25H19N3OS MolecularWeight: 409.50286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N3C1=CC(=C3C(=S)NC(=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CN1C2=CC=CC=C2N3C1=CC(=C3C(=S)NC(=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H19N3OS/c1-27-20-14-8-9-15-21(20)28-22(27)16-19(17-10-4-2-5-11-17)23(28)25(30)26-24(29)18-12-6-3-7-13-18/h2-16H,1H3,(H,26,29,30)