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

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)-4-piperidyl]-1-benzyl-pyrazole-4-carboxamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidinyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-1-benzylpyrazole-4-carboxamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)-4-piperidyl]-1-benzyl-pyrazole-4-carboxamide Formula: C18H23N5O2 MolecularWeight: 341.40752

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CN(N=C2)CC3=CC=CC=C3)CC(=O)N

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CN(N=C2)CC3=CC=CC=C3)CC(=O)N

InChI

InChI=1S/C18H23N5O2/c19-17(24)13-22-8-6-16(7-9-22)21-18(25)15-10-20-23(12-15)11-14-4-2-1-3-5-14/h1-5,10,12,16H,6-9,11,13H2,(H2,19,24)(H,21,25)