3-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]carbonyl-N-cyclopropyl-4-methyl-benzenesulfonamide

Systemtic Name: 3-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]carbonyl-N-cyclopropyl-4-methyl-benzenesulfonamide Openeye Name: 3-[4-(4-chloro-2-nitro-phenyl)piperazine-1-carbonyl]-N-cyclopropyl-4-methyl-benzenesulfonamide CAS Name: 3-[[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-oxomethyl]-N-cyclopropyl-4-methylbenzenesulfonamide IUPAC Name: 3-[4-(4-chloro-2-nitrophenyl)piperazine-1-carbonyl]-N-cyclopropyl-4-methylbenzenesulfonamide Traditional Name: 3-[4-(4-chloro-2-nitro-phenyl)piperazine-1-carbonyl]-N-cyclopropyl-4-methyl-benzenesulfonamide Formula: C21H23ClN4O5S MolecularWeight: 478.94912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)N3CCN(CC3)C4=C(C=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)N3CCN(CC3)C4=C(C=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H23ClN4O5S/c1-14-2-6-17(32(30,31)23-16-4-5-16)13-18(14)21(27)25-10-8-24(9-11-25)19-7-3-15(22)12-20(19)26(28)29/h2-3,6-7,12-13,16,23H,4-5,8-11H2,1H3