tert-butyl 3-(propan-2-ylamino)-4-pyrimidin-4-yl-piperazine-1-carboxylate

Systemtic Name: tert-butyl 3-(propan-2-ylamino)-4-pyrimidin-4-yl-piperazine-1-carboxylate Openeye Name: tert-butyl 3-(isopropylamino)-4-pyrimidin-4-yl-piperazine-1-carboxylate CAS Name: 3-(propan-2-ylamino)-4-(4-pyrimidinyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(propan-2-ylamino)-4-pyrimidin-4-ylpiperazine-1-carboxylate Traditional Name: 3-(isopropylamino)-4-(4-pyrimidyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C16H27N5O2 MolecularWeight: 321.41788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1CN(CCN1C2=NC=NC=C2)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)NC1CN(CCN1C2=NC=NC=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C16H27N5O2/c1-12(2)19-14-10-20(15(22)23-16(3,4)5)8-9-21(14)13-6-7-17-11-18-13/h6-7,11-12,14,19H,8-10H2,1-5H3