ethyl 2-oxidanylidene-2-[(4R)-6-propan-2-yl-4-(3-prop-2-enoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]ethanoate

Systemtic Name: ethyl 2-oxidanylidene-2-[(4R)-6-propan-2-yl-4-(3-prop-2-enoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]ethanoate Openeye Name: ethyl 2-[(4R)-4-(3-allyloxyphenyl)-6-isopropyl-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]-2-oxo-acetate CAS Name: 2-oxo-2-[(4R)-6-propan-2-yl-4-(3-prop-2-enoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-oxo-2-[(4R)-6-propan-2-yl-4-(3-prop-2-enoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]acetate Traditional Name: 2-[(4R)-4-(3-allyloxyphenyl)-6-isopropyl-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]-2-keto-acetic acid ethyl ester Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)C1=C(NC(=S)NC1C2=CC(=CC=C2)OCC=C)C(C)C

Isomeric SMILES

CCOC(=O)C(=O)C1=C(NC(=S)N[C@@H]1C2=CC(=CC=C2)OCC=C)C(C)C

InChI

InChI=1S/C20H24N2O4S/c1-5-10-26-14-9-7-8-13(11-14)17-15(18(23)19(24)25-6-2)16(12(3)4)21-20(27)22-17/h5,7-9,11-12,17H,1,6,10H2,2-4H3,(H2,21,22,27)/t17-/m1/s1