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

Systemtic Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide Openeye Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-N-[1-(2-thienyl)ethyl]piperidine-4-carboxamide CAS Name: 1-(2-methyl-5-nitrophenyl)sulfonyl-N-(1-thiophen-2-ylethyl)-4-piperidinecarboxamide IUPAC Name: 1-(2-methyl-5-nitrophenyl)sulfonyl-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide Traditional Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-N-[1-(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)NC(C)C3=CC=CS3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NC(C)C3=CC=CS3

InChI

InChI=1S/C19H23N3O5S2/c1-13-5-6-16(22(24)25)12-18(13)29(26,27)21-9-7-15(8-10-21)19(23)20-14(2)17-4-3-11-28-17/h3-6,11-12,14-15H,7-10H2,1-2H3,(H,20,23)