1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-(2-nitrophenyl)sulfanyl-ethanone

Systemtic Name: 1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-(2-nitrophenyl)sulfanyl-ethanone Openeye Name: 1-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-2-(2-nitrophenyl)sulfanyl-ethanone CAS Name: 1-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-2-[(2-nitrophenyl)thio]ethanone IUPAC Name: 1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-(2-nitrophenyl)sulfanylethanone Traditional Name: 1-[4-(5-chloro-2-methyl-phenyl)piperazino]-2-[(2-nitrophenyl)thio]ethanone Formula: C19H20ClN3O3S MolecularWeight: 405.8984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CSC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CSC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H20ClN3O3S/c1-14-6-7-15(20)12-17(14)21-8-10-22(11-9-21)19(24)13-27-18-5-3-2-4-16(18)23(25)26/h2-7,12H,8-11,13H2,1H3