(phenylmethyl) N-[(1S)-2-oxidanylidene-1-phenyl-2-[(1-pyrimidin-2-ylpiperidin-3-yl)methylamino]ethyl]carbamate

Systemtic Name: (phenylmethyl) N-[(1S)-2-oxidanylidene-1-phenyl-2-[(1-pyrimidin-2-ylpiperidin-3-yl)methylamino]ethyl]carbamate Openeye Name: benzyl N-[(1S)-2-oxo-1-phenyl-2-[(1-pyrimidin-2-yl-3-piperidyl)methylamino]ethyl]carbamate CAS Name: N-[(1S)-2-oxo-1-phenyl-2-[[1-(2-pyrimidinyl)-3-piperidinyl]methylamino]ethyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(1S)-2-oxo-1-phenyl-2-[(1-pyrimidin-2-ylpiperidin-3-yl)methylamino]ethyl]carbamate Traditional Name: N-[(1S)-2-keto-1-phenyl-2-[[1-(2-pyrimidyl)-3-piperidyl]methylamino]ethyl]carbamic acid benzyl ester Formula: C26H29N5O3 MolecularWeight: 459.54016

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=CC=N2)CNC(=O)C(C3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)C2=NC=CC=N2)CNC(=O)[C@H](C3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C26H29N5O3/c32-24(29-17-21-11-7-16-31(18-21)25-27-14-8-15-28-25)23(22-12-5-2-6-13-22)30-26(33)34-19-20-9-3-1-4-10-20/h1-6,8-10,12-15,21,23H,7,11,16-19H2,(H,29,32)(H,30,33)/t21?,23-/m0/s1