[2,5-dimethyl-1-(pyridin-2-ylmethyl)pyrrol-3-yl]-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [2,5-dimethyl-1-(pyridin-2-ylmethyl)pyrrol-3-yl]-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [2,5-dimethyl-1-(2-pyridylmethyl)pyrrol-3-yl]-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]methanone CAS Name: [2,5-dimethyl-1-(2-pyridinylmethyl)-3-pyrrolyl]-[4-(2-methyl-5-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: [2,5-dimethyl-1-(pyridin-2-ylmethyl)pyrrol-3-yl]-[4-(2-methyl-5-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [2,5-dimethyl-1-(2-pyridylmethyl)pyrrol-3-yl]-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazino]methanone Formula: C24H27N5O5S MolecularWeight: 497.56668

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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=C(N(C(=C3)C)CC4=CC=CC=N4)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=O)C3=C(N(C(=C3)C)CC4=CC=CC=N4)C

InChI

InChI=1S/C24H27N5O5S/c1-17-7-8-21(29(31)32)15-23(17)35(33,34)27-12-10-26(11-13-27)24(30)22-14-18(2)28(19(22)3)16-20-6-4-5-9-25-20/h4-9,14-15H,10-13,16H2,1-3H3