[4-(2-chlorophenyl)sulfonyl-3-nitro-phenyl]-[2-methyl-4-(3-methylphenyl)piperazin-1-yl]methanone

Systemtic Name: [4-(2-chlorophenyl)sulfonyl-3-nitro-phenyl]-[2-methyl-4-(3-methylphenyl)piperazin-1-yl]methanone Openeye Name: [4-(2-chlorophenyl)sulfonyl-3-nitro-phenyl]-[2-methyl-4-(m-tolyl)piperazin-1-yl]methanone CAS Name: [4-(2-chlorophenyl)sulfonyl-3-nitrophenyl]-[2-methyl-4-(3-methylphenyl)-1-piperazinyl]methanone IUPAC Name: [4-(2-chlorophenyl)sulfonyl-3-nitrophenyl]-[2-methyl-4-(3-methylphenyl)piperazin-1-yl]methanone Traditional Name: [4-(2-chlorophenyl)sulfonyl-3-nitro-phenyl]-[2-methyl-4-(m-tolyl)piperazino]methanone Formula: C25H24ClN3O5S MolecularWeight: 513.99316

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2=CC(=C(C=C2)S(=O)(=O)C3=CC=CC=C3Cl)[N+](=O)[O-])C4=CC=CC(=C4)C

Isomeric SMILES

CC1CN(CCN1C(=O)C2=CC(=C(C=C2)S(=O)(=O)C3=CC=CC=C3Cl)[N+](=O)[O-])C4=CC=CC(=C4)C

InChI

InChI=1S/C25H24ClN3O5S/c1-17-6-5-7-20(14-17)27-12-13-28(18(2)16-27)25(30)19-10-11-24(22(15-19)29(31)32)35(33,34)23-9-4-3-8-21(23)26/h3-11,14-15,18H,12-13,16H2,1-2H3