(phenylmethyl) N-[3-methyl-1-oxidanylidene-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[3-methyl-1-oxidanylidene-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-2-yl]carbamate Openeye Name: benzyl N-[2-methyl-1-(4-pyrimidin-2-ylpiperazine-1-carbonyl)propyl]carbamate CAS Name: N-[3-methyl-1-oxo-1-[4-(2-pyrimidinyl)-1-piperazinyl]butan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-methyl-1-oxo-1-(4-pyrimidin-2-ylpiperazin-1-yl)butan-2-yl]carbamate Traditional Name: N-[2-methyl-1-[4-(2-pyrimidyl)piperazine-1-carbonyl]propyl]carbamic acid benzyl ester Formula: C21H27N5O3 MolecularWeight: 397.47078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)C2=NC=CC=N2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)C(C(=O)N1CCN(CC1)C2=NC=CC=N2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H27N5O3/c1-16(2)18(24-21(28)29-15-17-7-4-3-5-8-17)19(27)25-11-13-26(14-12-25)20-22-9-6-10-23-20/h3-10,16,18H,11-15H2,1-2H3,(H,24,28)