4-(4-methylphenyl)-5-thiophen-2-ylsulfonyl-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepine

Systemtic Name: 4-(4-methylphenyl)-5-thiophen-2-ylsulfonyl-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepine Openeye Name: 4-(p-tolyl)-5-(2-thienylsulfonyl)-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepine CAS Name: 4-(4-methylphenyl)-5-thiophen-2-ylsulfonyl-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepine IUPAC Name: 4-(4-methylphenyl)-5-thiophen-2-ylsulfonyl-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepine Traditional Name: 4-(p-tolyl)-5-(2-thienylsulfonyl)-4,6-dihydropyrrolo[1,2-a][1,4]benzodiazepine Formula: C23H20N2O2S2 MolecularWeight: 420.5471

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C3=CC=CN3C4=CC=CC=C4CN2S(=O)(=O)C5=CC=CS5

Isomeric SMILES

CC1=CC=C(C=C1)C2C3=CC=CN3C4=CC=CC=C4CN2S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C23H20N2O2S2/c1-17-10-12-18(13-11-17)23-21-8-4-14-24(21)20-7-3-2-6-19(20)16-25(23)29(26,27)22-9-5-15-28-22/h2-15,23H,16H2,1H3