[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-[4-(4-methylpiperidin-1-yl)-3-nitro-phenyl]methanone

Systemtic Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-[4-(4-methylpiperidin-1-yl)-3-nitro-phenyl]methanone Openeye Name: [4-(4-methyl-1-piperidyl)-3-nitro-phenyl]-[4-(p-tolylsulfonyl)piperazin-1-yl]methanone CAS Name: [4-(4-methylphenyl)sulfonyl-1-piperazinyl]-[4-(4-methyl-1-piperidinyl)-3-nitrophenyl]methanone IUPAC Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-[4-(4-methylpiperidin-1-yl)-3-nitrophenyl]methanone Traditional Name: [4-(4-methylpiperidino)-3-nitro-phenyl]-(4-tosylpiperazino)methanone Formula: C24H30N4O5S MolecularWeight: 486.5838

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C24H30N4O5S/c1-18-3-6-21(7-4-18)34(32,33)27-15-13-26(14-16-27)24(29)20-5-8-22(23(17-20)28(30)31)25-11-9-19(2)10-12-25/h3-8,17,19H,9-16H2,1-2H3