1-(2-methylphenyl)-2-(3-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4-thione

Systemtic Name: 1-(2-methylphenyl)-2-(3-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4-thione Openeye Name: 2-(3-nitrophenyl)-1-(o-tolyl)-5,6,7,8-tetrahydroquinazoline-4-thione CAS Name: 1-(2-methylphenyl)-2-(3-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4-thione IUPAC Name: 1-(2-methylphenyl)-2-(3-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4-thione Traditional Name: 2-(3-nitrophenyl)-1-(o-tolyl)-5,6,7,8-tetrahydroquinazoline-4-thione Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C3=C(CCCC3)C(=S)N=C2C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1N2C3=C(CCCC3)C(=S)N=C2C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O2S/c1-14-7-2-4-11-18(14)23-19-12-5-3-10-17(19)21(27)22-20(23)15-8-6-9-16(13-15)24(25)26/h2,4,6-9,11,13H,3,5,10,12H2,1H3