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

Systemtic Name: methyl 2-oxidanylidene-2-[(4R)-4-(3-prop-2-enoxyphenyl)-2-sulfanylidene-6-thiophen-2-yl-3,4-dihydro-1H-pyrimidin-5-yl]ethanoate Openeye Name: methyl 2-[(4R)-4-(3-allyloxyphenyl)-6-(2-thienyl)-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]-2-oxo-acetate CAS Name: 2-oxo-2-[(4R)-4-(3-prop-2-enoxyphenyl)-2-sulfanylidene-6-thiophen-2-yl-3,4-dihydro-1H-pyrimidin-5-yl]acetic acid methyl ester IUPAC Name: methyl 2-oxo-2-[(4R)-4-(3-prop-2-enoxyphenyl)-2-sulfanylidene-6-thiophen-2-yl-3,4-dihydro-1H-pyrimidin-5-yl]acetate Traditional Name: 2-[(4R)-4-(3-allyloxyphenyl)-6-(2-thienyl)-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]-2-keto-acetic acid methyl ester Formula: C20H18N2O4S2 MolecularWeight: 414.49792

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=O)C1=C(NC(=S)NC1C2=CC(=CC=C2)OCC=C)C3=CC=CS3

Isomeric SMILES

COC(=O)C(=O)C1=C(NC(=S)N[C@@H]1C2=CC(=CC=C2)OCC=C)C3=CC=CS3

InChI

InChI=1S/C20H18N2O4S2/c1-3-9-26-13-7-4-6-12(11-13)16-15(18(23)19(24)25-2)17(22-20(27)21-16)14-8-5-10-28-14/h3-8,10-11,16H,1,9H2,2H3,(H2,21,22,27)/t16-/m1/s1