ethyl 4-azanyl-2-[2-[2-[2-(cyclohexen-1-yl)ethylamino]-2-oxidanylidene-ethoxy]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[2-[2-[2-(cyclohexen-1-yl)ethylamino]-2-oxidanylidene-ethoxy]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[2-[2-[2-(cyclohexen-1-yl)ethylamino]-2-oxo-ethoxy]-2-oxo-ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[2-[2-[2-(1-cyclohexenyl)ethylamino]-2-oxoethoxy]-2-oxoethyl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[2-[2-[2-(cyclohexen-1-yl)ethylamino]-2-oxoethoxy]-2-oxoethyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[2-[2-[2-(cyclohexen-1-yl)ethylamino]-2-keto-ethoxy]-2-keto-ethyl]thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C19H26N4O5S MolecularWeight: 422.49854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SCC(=O)OCC(=O)NCCC2=CCCCC2

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)SCC(=O)OCC(=O)NCCC2=CCCCC2

InChI

InChI=1S/C19H26N4O5S/c1-2-27-18(26)14-10-22-19(23-17(14)20)29-12-16(25)28-11-15(24)21-9-8-13-6-4-3-5-7-13/h6,10H,2-5,7-9,11-12H2,1H3,(H,21,24)(H2,20,22,23)