N-methyl-N-[2-(4-nitrophenyl)ethyl]-4-[2-(3-thiophen-2-ylpyrazol-1-yl)ethanoylamino]piperidine-4-carboxamide

Systemtic Name: N-methyl-N-[2-(4-nitrophenyl)ethyl]-4-[2-(3-thiophen-2-ylpyrazol-1-yl)ethanoylamino]piperidine-4-carboxamide Openeye Name: N-methyl-N-[2-(4-nitrophenyl)ethyl]-4-[[2-[3-(2-thienyl)pyrazol-1-yl]acetyl]amino]piperidine-4-carboxamide CAS Name: N-methyl-N-[2-(4-nitrophenyl)ethyl]-4-[[1-oxo-2-(3-thiophen-2-yl-1-pyrazolyl)ethyl]amino]-4-piperidinecarboxamide IUPAC Name: N-methyl-N-[2-(4-nitrophenyl)ethyl]-4-[[2-(3-thiophen-2-ylpyrazol-1-yl)acetyl]amino]piperidine-4-carboxamide Traditional Name: N-methyl-N-[2-(4-nitrophenyl)ethyl]-4-[[2-[3-(2-thienyl)pyrazol-1-yl]acetyl]amino]isonipecotamide Formula: C24H28N6O4S MolecularWeight: 496.58192

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=C(C=C1)[N+](=O)[O-])C(=O)C2(CCNCC2)NC(=O)CN3C=CC(=N3)C4=CC=CS4

Isomeric SMILES

CN(CCC1=CC=C(C=C1)[N+](=O)[O-])C(=O)C2(CCNCC2)NC(=O)CN3C=CC(=N3)C4=CC=CS4

InChI

InChI=1S/C24H28N6O4S/c1-28(14-8-18-4-6-19(7-5-18)30(33)34)23(32)24(10-12-25-13-11-24)26-22(31)17-29-15-9-20(27-29)21-3-2-16-35-21/h2-7,9,15-16,25H,8,10-14,17H2,1H3,(H,26,31)