(1-ethyl-2,5-dimethyl-pyrrol-3-yl)-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (1-ethyl-2,5-dimethyl-pyrrol-3-yl)-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (1-ethyl-2,5-dimethyl-pyrrol-3-yl)-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (1-ethyl-2,5-dimethyl-3-pyrrolyl)-[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (1-ethyl-2,5-dimethylpyrrol-3-yl)-[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (1-ethyl-2,5-dimethyl-pyrrol-3-yl)-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]methanone Formula: C20H26N4O6S MolecularWeight: 450.50864

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=C1C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-])C

Isomeric SMILES

CCN1C(=CC(=C1C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-])C

InChI

InChI=1S/C20H26N4O6S/c1-5-23-14(2)12-17(15(23)3)20(25)21-8-10-22(11-9-21)31(28,29)16-6-7-19(30-4)18(13-16)24(26)27/h6-7,12-13H,5,8-11H2,1-4H3