1-[4-(2-methylphenyl)piperazin-1-yl]-2-(4-nitrophenyl)sulfanyl-ethanone

Systemtic Name: 1-[4-(2-methylphenyl)piperazin-1-yl]-2-(4-nitrophenyl)sulfanyl-ethanone Openeye Name: 2-(4-nitrophenyl)sulfanyl-1-[4-(o-tolyl)piperazin-1-yl]ethanone CAS Name: 1-[4-(2-methylphenyl)-1-piperazinyl]-2-[(4-nitrophenyl)thio]ethanone IUPAC Name: 1-[4-(2-methylphenyl)piperazin-1-yl]-2-(4-nitrophenyl)sulfanylethanone Traditional Name: 2-[(4-nitrophenyl)thio]-1-[4-(o-tolyl)piperazino]ethanone Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C(=O)CSC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O3S/c1-15-4-2-3-5-18(15)20-10-12-21(13-11-20)19(23)14-26-17-8-6-16(7-9-17)22(24)25/h2-9H,10-14H2,1H3