(3R)-1-(1,5-dimethylpyrazol-4-yl)sulfonyl-N-[1-ethyl-3-(2-methylpropylcarbamoyl)pyrazol-4-yl]piperidine-3-carboxamide

Systemtic Name: (3R)-1-(1,5-dimethylpyrazol-4-yl)sulfonyl-N-[1-ethyl-3-(2-methylpropylcarbamoyl)pyrazol-4-yl]piperidine-3-carboxamide Openeye Name: (3R)-1-(1,5-dimethylpyrazol-4-yl)sulfonyl-N-[1-ethyl-3-(isobutylcarbamoyl)pyrazol-4-yl]piperidine-3-carboxamide CAS Name: (3R)-1-[(1,5-dimethyl-4-pyrazolyl)sulfonyl]-N-[1-ethyl-3-[(2-methylpropylamino)-oxomethyl]-4-pyrazolyl]-3-piperidinecarboxamide IUPAC Name: (3R)-1-(1,5-dimethylpyrazol-4-yl)sulfonyl-N-[1-ethyl-3-(2-methylpropylcarbamoyl)pyrazol-4-yl]piperidine-3-carboxamide Traditional Name: (3R)-1-(1,5-dimethylpyrazol-4-yl)sulfonyl-N-[1-ethyl-3-(isobutylcarbamoyl)pyrazol-4-yl]nipecotamide Formula: C21H33N7O4S MolecularWeight: 479.59622

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NCC(C)C)NC(=O)C2CCCN(C2)S(=O)(=O)C3=C(N(N=C3)C)C

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NCC(C)C)NC(=O)[C@@H]2CCCN(C2)S(=O)(=O)C3=C(N(N=C3)C)C

InChI

InChI=1S/C21H33N7O4S/c1-6-27-13-17(19(25-27)21(30)22-10-14(2)3)24-20(29)16-8-7-9-28(12-16)33(31,32)18-11-23-26(5)15(18)4/h11,13-14,16H,6-10,12H2,1-5H3,(H,22,30)(H,24,29)/t16-/m1/s1