N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-1-(pyridin-3-ylmethyl)piperidine-4-carboxamide

Systemtic Name: N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-1-(pyridin-3-ylmethyl)piperidine-4-carboxamide Openeye Name: N-[(1S)-2-amino-1-benzyl-2-oxo-ethyl]-1-(3-pyridylmethyl)piperidine-4-carboxamide CAS Name: N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-1-(3-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-1-(pyridin-3-ylmethyl)piperidine-4-carboxamide Traditional Name: N-[(1S)-2-amino-1-benzyl-2-keto-ethyl]-1-(3-pyridylmethyl)isonipecotamide Formula: C21H26N4O2 MolecularWeight: 366.45674

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC(CC2=CC=CC=C2)C(=O)N)CC3=CN=CC=C3

Isomeric SMILES

C1CN(CCC1C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N)CC3=CN=CC=C3

InChI

InChI=1S/C21H26N4O2/c22-20(26)19(13-16-5-2-1-3-6-16)24-21(27)18-8-11-25(12-9-18)15-17-7-4-10-23-14-17/h1-7,10,14,18-19H,8-9,11-13,15H2,(H2,22,26)(H,24,27)/t19-/m0/s1