ethyl 4-azanyl-2-[1-(2-ethylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[1-(2-ethylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[2-(2-ethyl-1-piperidyl)-1-methyl-2-oxo-ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[1-(2-ethyl-1-piperidinyl)-1-oxopropan-2-yl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[1-(2-ethylpiperidin-1-yl)-1-oxopropan-2-yl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[2-(2-ethylpiperidino)-2-keto-1-methyl-ethyl]thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C17H26N4O3S MolecularWeight: 366.47834

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)C(C)SC2=NC=C(C(=N2)N)C(=O)OCC

Isomeric SMILES

CCC1CCCCN1C(=O)C(C)SC2=NC=C(C(=N2)N)C(=O)OCC

InChI

InChI=1S/C17H26N4O3S/c1-4-12-8-6-7-9-21(12)15(22)11(3)25-17-19-10-13(14(18)20-17)16(23)24-5-2/h10-12H,4-9H2,1-3H3,(H2,18,19,20)