(phenylmethyl) N-[4-oxidanylidene-4-[(1-pyrimidin-2-ylpiperidin-3-yl)methylamino]butyl]carbamate

Systemtic Name: (phenylmethyl) N-[4-oxidanylidene-4-[(1-pyrimidin-2-ylpiperidin-3-yl)methylamino]butyl]carbamate Openeye Name: benzyl N-[4-oxo-4-[(1-pyrimidin-2-yl-3-piperidyl)methylamino]butyl]carbamate CAS Name: N-[4-oxo-4-[[1-(2-pyrimidinyl)-3-piperidinyl]methylamino]butyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[4-oxo-4-[(1-pyrimidin-2-ylpiperidin-3-yl)methylamino]butyl]carbamate Traditional Name: N-[4-keto-4-[[1-(2-pyrimidyl)-3-piperidyl]methylamino]butyl]carbamic acid benzyl ester Formula: C22H29N5O3 MolecularWeight: 411.49736

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=CC=N2)CNC(=O)CCCNC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CC(CN(C1)C2=NC=CC=N2)CNC(=O)CCCNC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C22H29N5O3/c28-20(10-4-11-25-22(29)30-17-18-7-2-1-3-8-18)26-15-19-9-5-14-27(16-19)21-23-12-6-13-24-21/h1-3,6-8,12-13,19H,4-5,9-11,14-17H2,(H,25,29)(H,26,28)