4-(4-cyclopropylcarbonylpiperazin-1-yl)-N-[2-[di(propan-2-yl)amino]ethyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-(4-cyclopropylcarbonylpiperazin-1-yl)-N-[2-[di(propan-2-yl)amino]ethyl]-3-nitro-benzenesulfonamide Openeye Name: 4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-[2-(diisopropylamino)ethyl]-3-nitro-benzenesulfonamide CAS Name: 4-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-N-[2-[di(propan-2-yl)amino]ethyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-[4-(cyclopropanecarbonyl)piperazin-1-yl]-N-[2-[di(propan-2-yl)amino]ethyl]-3-nitrobenzenesulfonamide Traditional Name: 4-[4-(cyclopropanecarbonyl)piperazino]-N-[2-(diisopropylamino)ethyl]-3-nitro-benzenesulfonamide Formula: C22H35N5O5S MolecularWeight: 481.6088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCNS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3CC3)[N+](=O)[O-])C(C)C

Isomeric SMILES

CC(C)N(CCNS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3CC3)[N+](=O)[O-])C(C)C

InChI

InChI=1S/C22H35N5O5S/c1-16(2)26(17(3)4)10-9-23-33(31,32)19-7-8-20(21(15-19)27(29)30)24-11-13-25(14-12-24)22(28)18-5-6-18/h7-8,15-18,23H,5-6,9-14H2,1-4H3