5-(2-methylpropyl)-N-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]-1H-pyrazole-3-carboxamide

Systemtic Name: 5-(2-methylpropyl)-N-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]-1H-pyrazole-3-carboxamide Openeye Name: 5-isobutyl-N-[(3S)-1-pyrimidin-2-yl-3-piperidyl]-1H-pyrazole-3-carboxamide CAS Name: 5-(2-methylpropyl)-N-[(3S)-1-(2-pyrimidinyl)-3-piperidinyl]-1H-pyrazole-3-carboxamide IUPAC Name: 5-(2-methylpropyl)-N-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]-1H-pyrazole-3-carboxamide Traditional Name: 5-isobutyl-N-[(3S)-1-(2-pyrimidyl)-3-piperidyl]-1H-pyrazole-3-carboxamide Formula: C17H24N6O MolecularWeight: 328.41206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=NN1)C(=O)NC2CCCN(C2)C3=NC=CC=N3

Isomeric SMILES

CC(C)CC1=CC(=NN1)C(=O)N[C@H]2CCCN(C2)C3=NC=CC=N3

InChI

InChI=1S/C17H24N6O/c1-12(2)9-14-10-15(22-21-14)16(24)20-13-5-3-8-23(11-13)17-18-6-4-7-19-17/h4,6-7,10,12-13H,3,5,8-9,11H2,1-2H3,(H,20,24)(H,21,22)/t13-/m0/s1