methyl 2-[4-(2-ethoxy-2-oxidanylidene-ethyl)piperazin-1-yl]-4-(propan-2-ylamino)pyrimidine-5-carboxylate

Systemtic Name: methyl 2-[4-(2-ethoxy-2-oxidanylidene-ethyl)piperazin-1-yl]-4-(propan-2-ylamino)pyrimidine-5-carboxylate Openeye Name: methyl 2-[4-(2-ethoxy-2-oxo-ethyl)piperazin-1-yl]-4-(isopropylamino)pyrimidine-5-carboxylate CAS Name: 2-[4-(2-ethoxy-2-oxoethyl)-1-piperazinyl]-4-(propan-2-ylamino)-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 2-[4-(2-ethoxy-2-oxoethyl)piperazin-1-yl]-4-(propan-2-ylamino)pyrimidine-5-carboxylate Traditional Name: 2-[4-(2-ethoxy-2-keto-ethyl)piperazino]-4-(isopropylamino)pyrimidine-5-carboxylic acid methyl ester Formula: C17H27N5O4 MolecularWeight: 365.42738

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCN(CC1)C2=NC=C(C(=N2)NC(C)C)C(=O)OC

Isomeric SMILES

CCOC(=O)CN1CCN(CC1)C2=NC=C(C(=N2)NC(C)C)C(=O)OC

InChI

InChI=1S/C17H27N5O4/c1-5-26-14(23)11-21-6-8-22(9-7-21)17-18-10-13(16(24)25-4)15(20-17)19-12(2)3/h10,12H,5-9,11H2,1-4H3,(H,18,19,20)