(3S)-3-[[2-(3,5-dimethylpyrazol-1-yl)ethanoylamino]carbamoyl]-N-phenyl-piperidine-1-carboxamide

Systemtic Name: (3S)-3-[[2-(3,5-dimethylpyrazol-1-yl)ethanoylamino]carbamoyl]-N-phenyl-piperidine-1-carboxamide Openeye Name: (3S)-3-[[[2-(3,5-dimethylpyrazol-1-yl)acetyl]amino]carbamoyl]-N-phenyl-piperidine-1-carboxamide CAS Name: (3S)-3-[[[2-(3,5-dimethyl-1-pyrazolyl)-1-oxoethyl]hydrazo]-oxomethyl]-N-phenyl-1-piperidinecarboxamide IUPAC Name: (3S)-3-[[[2-(3,5-dimethylpyrazol-1-yl)acetyl]amino]carbamoyl]-N-phenylpiperidine-1-carboxamide Traditional Name: (3S)-3-[[[2-(3,5-dimethylpyrazol-1-yl)acetyl]amino]carbamoyl]-N-phenyl-piperidine-1-carboxamide Formula: C20H26N6O3 MolecularWeight: 398.45884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC(=O)NNC(=O)C2CCCN(C2)C(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NN1CC(=O)NNC(=O)[C@H]2CCCN(C2)C(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C20H26N6O3/c1-14-11-15(2)26(24-14)13-18(27)22-23-19(28)16-7-6-10-25(12-16)20(29)21-17-8-4-3-5-9-17/h3-5,8-9,11,16H,6-7,10,12-13H2,1-2H3,(H,21,29)(H,22,27)(H,23,28)/t16-/m0/s1