1-(2-methyl-5-nitro-phenyl)sulfonyl-N-(2-thiophen-2-ylethyl)piperidine-4-carboxamide

Systemtic Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-N-(2-thiophen-2-ylethyl)piperidine-4-carboxamide Openeye Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-N-[2-(2-thienyl)ethyl]piperidine-4-carboxamide CAS Name: 1-(2-methyl-5-nitrophenyl)sulfonyl-N-(2-thiophen-2-ylethyl)-4-piperidinecarboxamide IUPAC Name: 1-(2-methyl-5-nitrophenyl)sulfonyl-N-(2-thiophen-2-ylethyl)piperidine-4-carboxamide Traditional Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-N-[2-(2-thienyl)ethyl]isonipecotamide Formula: C19H23N3O5S2 MolecularWeight: 437.53302

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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)NCCC3=CC=CS3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NCCC3=CC=CS3

InChI

InChI=1S/C19H23N3O5S2/c1-14-4-5-16(22(24)25)13-18(14)29(26,27)21-10-7-15(8-11-21)19(23)20-9-6-17-3-2-12-28-17/h2-5,12-13,15H,6-11H2,1H3,(H,20,23)