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

Systemtic Name: N-methyl-1-(2-methyl-5-nitro-phenyl)sulfonyl-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide Openeye Name: N-methyl-1-(2-methyl-5-nitro-phenyl)sulfonyl-N-[1-(2-thienyl)ethyl]piperidine-4-carboxamide CAS Name: N-methyl-1-(2-methyl-5-nitrophenyl)sulfonyl-N-(1-thiophen-2-ylethyl)-4-piperidinecarboxamide IUPAC Name: N-methyl-1-(2-methyl-5-nitrophenyl)sulfonyl-N-(1-thiophen-2-ylethyl)piperidine-4-carboxamide Traditional Name: N-methyl-1-(2-methyl-5-nitro-phenyl)sulfonyl-N-[1-(2-thienyl)ethyl]isonipecotamide Formula: C20H25N3O5S2 MolecularWeight: 451.5596

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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)N(C)C(C)C3=CC=CS3

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O5S2/c1-14-6-7-17(23(25)26)13-19(14)30(27,28)22-10-8-16(9-11-22)20(24)21(3)15(2)18-5-4-12-29-18/h4-7,12-13,15-16H,8-11H2,1-3H3