N-(4-methoxyphenyl)-4-methyl-N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-(4-methoxyphenyl)-4-methyl-N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-3-nitro-benzenesulfonamide Openeye Name: N-(4-methoxyphenyl)-4-methyl-3-nitro-N-[2-oxo-2-[4-(p-tolylsulfonyl)piperazin-1-yl]ethyl]benzenesulfonamide CAS Name: N-(4-methoxyphenyl)-4-methyl-N-[2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-3-nitrobenzenesulfonamide IUPAC Name: N-(4-methoxyphenyl)-4-methyl-N-[2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]-3-nitrobenzenesulfonamide Traditional Name: N-[2-keto-2-(4-tosylpiperazino)ethyl]-N-(4-methoxyphenyl)-4-methyl-3-nitro-benzenesulfonamide Formula: C27H30N4O8S2 MolecularWeight: 602.6791

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN(C3=CC=C(C=C3)OC)S(=O)(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN(C3=CC=C(C=C3)OC)S(=O)(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C27H30N4O8S2/c1-20-4-11-24(12-5-20)40(35,36)29-16-14-28(15-17-29)27(32)19-30(22-7-9-23(39-3)10-8-22)41(37,38)25-13-6-21(2)26(18-25)31(33)34/h4-13,18H,14-17,19H2,1-3H3