ethyl 4-azanyl-2-(2-ethylpiperidin-1-yl)carbonylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-(2-ethylpiperidin-1-yl)carbonylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-(2-ethylpiperidine-1-carbonyl)sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[(2-ethyl-1-piperidinyl)-oxomethyl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-(2-ethylpiperidine-1-carbonyl)sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[(2-ethylpiperidine-1-carbonyl)thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C15H22N4O3S MolecularWeight: 338.42518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N4O3S/c1-3-10-7-5-6-8-19(10)15(21)23-14-17-9-11(12(16)18-14)13(20)22-4-2/h9-10H,3-8H2,1-2H3,(H2,16,17,18)