[1-(cycloheptylamino)-1-oxidanylidene-propan-2-yl] 2-[methyl(pyrimidin-2-yl)amino]ethanoate

Systemtic Name: [1-(cycloheptylamino)-1-oxidanylidene-propan-2-yl] 2-[methyl(pyrimidin-2-yl)amino]ethanoate Openeye Name: [2-(cycloheptylamino)-1-methyl-2-oxo-ethyl] 2-[methyl(pyrimidin-2-yl)amino]acetate CAS Name: 2-[methyl(2-pyrimidinyl)amino]acetic acid [1-(cycloheptylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cycloheptylamino)-1-oxopropan-2-yl] 2-[methyl(pyrimidin-2-yl)amino]acetate Traditional Name: 2-[methyl(2-pyrimidyl)amino]acetic acid [2-(cycloheptylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H26N4O3 MolecularWeight: 334.41334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCCC1)OC(=O)CN(C)C2=NC=CC=N2

Isomeric SMILES

CC(C(=O)NC1CCCCCC1)OC(=O)CN(C)C2=NC=CC=N2

InChI

InChI=1S/C17H26N4O3/c1-13(16(23)20-14-8-5-3-4-6-9-14)24-15(22)12-21(2)17-18-10-7-11-19-17/h7,10-11,13-14H,3-6,8-9,12H2,1-2H3,(H,20,23)