1-(2-methyl-5-nitro-phenyl)sulfonyl-N-(1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-N-(1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide Openeye Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-N-(1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide CAS Name: 1-(2-methyl-5-nitrophenyl)sulfonyl-N-(1,3,4-thiadiazol-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-(2-methyl-5-nitrophenyl)sulfonyl-N-(1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-N-(1,3,4-thiadiazol-2-yl)isonipecotamide Formula: C15H17N5O5S2 MolecularWeight: 411.45598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NC3=NN=CS3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NC3=NN=CS3

InChI

InChI=1S/C15H17N5O5S2/c1-10-2-3-12(20(22)23)8-13(10)27(24,25)19-6-4-11(5-7-19)14(21)17-15-18-16-9-26-15/h2-3,8-9,11H,4-7H2,1H3,(H,17,18,21)