ethyl 4-[2-(cyclohexen-1-yl)ethylamino]-2-methylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[2-(cyclohexen-1-yl)ethylamino]-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[2-(cyclohexen-1-yl)ethylamino]-2-methylsulfanyl-pyrimidine-5-carboxylate CAS Name: 4-[2-(1-cyclohexenyl)ethylamino]-2-(methylthio)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(cyclohexen-1-yl)ethylamino]-2-methylsulfanylpyrimidine-5-carboxylate Traditional Name: 4-[2-(cyclohexen-1-yl)ethylamino]-2-(methylthio)pyrimidine-5-carboxylic acid ethyl ester Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NCCC2=CCCCC2)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NCCC2=CCCCC2)SC

InChI

InChI=1S/C16H23N3O2S/c1-3-21-15(20)13-11-18-16(22-2)19-14(13)17-10-9-12-7-5-4-6-8-12/h7,11H,3-6,8-10H2,1-2H3,(H,17,18,19)