N-(2-methylphenyl)-2-[(4-oxidanylidene-7-phenyl-1,5-dihydropyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(2-methylphenyl)-2-[(4-oxidanylidene-7-phenyl-1,5-dihydropyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: N-(o-tolyl)-2-[(4-oxo-7-phenyl-1,5-dihydropyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-(2-methylphenyl)-2-[(4-oxo-7-phenyl-1,5-dihydropyrrolo[3,2-d]pyrimidin-2-yl)thio]acetamide IUPAC Name: N-(2-methylphenyl)-2-[(4-oxo-7-phenyl-1,5-dihydropyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: 2-[(4-keto-7-phenyl-1,5-dihydropyrrolo[3,2-d]pyrimidin-2-yl)thio]-N-(o-tolyl)acetamide Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CSC2=NC(=O)C3=C(N2)C(=CN3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CSC2=NC(=O)C3=C(N2)C(=CN3)C4=CC=CC=C4

InChI

InChI=1S/C21H18N4O2S/c1-13-7-5-6-10-16(13)23-17(26)12-28-21-24-18-15(14-8-3-2-4-9-14)11-22-19(18)20(27)25-21/h2-11,22H,12H2,1H3,(H,23,26)(H,24,25,27)