[4-(2-methylphenyl)piperazin-1-yl]-(3-nitrophenyl)methanethione

Systemtic Name: [4-(2-methylphenyl)piperazin-1-yl]-(3-nitrophenyl)methanethione Openeye Name: (3-nitrophenyl)-[4-(o-tolyl)piperazin-1-yl]methanethione CAS Name: [4-(2-methylphenyl)-1-piperazinyl]-(3-nitrophenyl)methanethione IUPAC Name: [4-(2-methylphenyl)piperazin-1-yl]-(3-nitrophenyl)methanethione Traditional Name: (3-nitrophenyl)-[4-(o-tolyl)piperazino]methanethione Formula: C18H19N3O2S MolecularWeight: 341.42736

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(=S)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(=S)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O2S/c1-14-5-2-3-8-17(14)19-9-11-20(12-10-19)18(24)15-6-4-7-16(13-15)21(22)23/h2-8,13H,9-12H2,1H3