N-[1-ethyl-3-(phenylcarbamoyl)pyrazol-4-yl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-ethyl-3-(phenylcarbamoyl)pyrazol-4-yl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-ethyl-3-(phenylcarbamoyl)pyrazol-4-yl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[3-[anilino(oxo)methyl]-1-ethyl-4-pyrazolyl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-ethyl-3-(phenylcarbamoyl)pyrazol-4-yl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: N-[1-ethyl-3-(phenylcarbamoyl)pyrazol-4-yl]-1-mesyl-isonipecotamide Formula: C19H25N5O4S MolecularWeight: 419.4979

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2=CC=CC=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2=CC=CC=C2)NC(=O)C3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C19H25N5O4S/c1-3-23-13-16(17(22-23)19(26)20-15-7-5-4-6-8-15)21-18(25)14-9-11-24(12-10-14)29(2,27)28/h4-8,13-14H,3,9-12H2,1-2H3,(H,20,26)(H,21,25)