N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-1-(phenylmethyl)-3-pyridin-3-yl-pyrazole-4-carboxamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-1-(phenylmethyl)-3-pyridin-3-yl-pyrazole-4-carboxamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)-4-piperidyl]-1-benzyl-3-(3-pyridyl)pyrazole-4-carboxamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidinyl]-1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolecarboxamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-1-benzyl-3-pyridin-3-ylpyrazole-4-carboxamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)-4-piperidyl]-1-benzyl-3-(3-pyridyl)pyrazole-4-carboxamide Formula: C23H26N6O2 MolecularWeight: 418.49154

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4)CC(=O)N

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4)CC(=O)N

InChI

InChI=1S/C23H26N6O2/c24-21(30)16-28-11-8-19(9-12-28)26-23(31)20-15-29(14-17-5-2-1-3-6-17)27-22(20)18-7-4-10-25-13-18/h1-7,10,13,15,19H,8-9,11-12,14,16H2,(H2,24,30)(H,26,31)