[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-(4-pyrrol-1-ylphenyl)methanone

Systemtic Name: [4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-(4-pyrrol-1-ylphenyl)methanone Openeye Name: [4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-(4-pyrrol-1-ylphenyl)methanone CAS Name: [4-(2-methyl-5-nitrophenyl)sulfonyl-1-piperazinyl]-[4-(1-pyrrolyl)phenyl]methanone IUPAC Name: [4-(2-methyl-5-nitrophenyl)sulfonylpiperazin-1-yl]-(4-pyrrol-1-ylphenyl)methanone Traditional Name: [4-(2-methyl-5-nitro-phenyl)sulfonylpiperazino]-(4-pyrrol-1-ylphenyl)methanone Formula: C22H22N4O5S MolecularWeight: 454.49888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)N4C=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)N4C=CC=C4

InChI

InChI=1S/C22H22N4O5S/c1-17-4-7-20(26(28)29)16-21(17)32(30,31)25-14-12-24(13-15-25)22(27)18-5-8-19(9-6-18)23-10-2-3-11-23/h2-11,16H,12-15H2,1H3