N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-4-[2-(3-pyridin-3-ylpyrazol-1-yl)ethanoylamino]piperidine-4-carboxamide

Systemtic Name: N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-4-[2-(3-pyridin-3-ylpyrazol-1-yl)ethanoylamino]piperidine-4-carboxamide Openeye Name: N-[2-(p-tolylsulfonylamino)ethyl]-4-[[2-[3-(3-pyridyl)pyrazol-1-yl]acetyl]amino]piperidine-4-carboxamide CAS Name: N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-4-[[1-oxo-2-[3-(3-pyridinyl)-1-pyrazolyl]ethyl]amino]-4-piperidinecarboxamide IUPAC Name: N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-4-[[2-(3-pyridin-3-ylpyrazol-1-yl)acetyl]amino]piperidine-4-carboxamide Traditional Name: 4-[[2-[3-(3-pyridyl)pyrazol-1-yl]acetyl]amino]-N-[2-(tosylamino)ethyl]isonipecotamide Formula: C25H31N7O4S MolecularWeight: 525.62314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCNC(=O)C2(CCNCC2)NC(=O)CN3C=CC(=N3)C4=CN=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCNC(=O)C2(CCNCC2)NC(=O)CN3C=CC(=N3)C4=CN=CC=C4

InChI

InChI=1S/C25H31N7O4S/c1-19-4-6-21(7-5-19)37(35,36)29-15-14-28-24(34)25(9-12-26-13-10-25)30-23(33)18-32-16-8-22(31-32)20-3-2-11-27-17-20/h2-8,11,16-17,26,29H,9-10,12-15,18H2,1H3,(H,28,34)(H,30,33)