[1-[(2,5-dimethoxyphenyl)methyl]piperidin-2-yl]methyl 4-(3-nitro-5-sulfamoyl-thiophen-2-yl)piperazine-1-carboxylate

Systemtic Name: [1-[(2,5-dimethoxyphenyl)methyl]piperidin-2-yl]methyl 4-(3-nitro-5-sulfamoyl-thiophen-2-yl)piperazine-1-carboxylate Openeye Name: [1-[(2,5-dimethoxyphenyl)methyl]-2-piperidyl]methyl 4-(3-nitro-5-sulfamoyl-2-thienyl)piperazine-1-carboxylate CAS Name: 4-(3-nitro-5-sulfamoyl-2-thiophenyl)-1-piperazinecarboxylic acid [1-[(2,5-dimethoxyphenyl)methyl]-2-piperidinyl]methyl ester IUPAC Name: [1-[(2,5-dimethoxyphenyl)methyl]piperidin-2-yl]methyl 4-(3-nitro-5-sulfamoylthiophen-2-yl)piperazine-1-carboxylate Traditional Name: 4-(3-nitro-5-sulfamoyl-2-thienyl)piperazine-1-carboxylic acid [1-(2,5-dimethoxybenzyl)-2-piperidyl]methyl ester Formula: C24H33N5O8S2 MolecularWeight: 583.67752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN2CCCCC2COC(=O)N3CCN(CC3)C4=C(C=C(S4)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN2CCCCC2COC(=O)N3CCN(CC3)C4=C(C=C(S4)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C24H33N5O8S2/c1-35-19-6-7-21(36-2)17(13-19)15-28-8-4-3-5-18(28)16-37-24(30)27-11-9-26(10-12-27)23-20(29(31)32)14-22(38-23)39(25,33)34/h6-7,13-14,18H,3-5,8-12,15-16H2,1-2H3,(H2,25,33,34)