methyl (Z)-3-(3-butoxy-4-methoxy-phenyl)-2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)prop-2-enoate

Systemtic Name: methyl (Z)-3-(3-butoxy-4-methoxy-phenyl)-2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)prop-2-enoate Openeye Name: methyl (Z)-3-(3-butoxy-4-methoxy-phenyl)-2-(4-oxo-2-thioxo-1H-pyrimidin-6-yl)prop-2-enoate CAS Name: (Z)-3-(3-butoxy-4-methoxyphenyl)-2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-3-(3-butoxy-4-methoxyphenyl)-2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)prop-2-enoate Traditional Name: (Z)-3-(3-butoxy-4-methoxy-phenyl)-2-(4-keto-2-thioxo-1H-pyrimidin-6-yl)acrylic acid methyl ester Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)C=C(C2=CC(=O)NC(=S)N2)C(=O)OC)OC

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)/C=C(/C2=CC(=O)NC(=S)N2)\C(=O)OC)OC

InChI

InChI=1S/C19H22N2O5S/c1-4-5-8-26-16-10-12(6-7-15(16)24-2)9-13(18(23)25-3)14-11-17(22)21-19(27)20-14/h6-7,9-11H,4-5,8H2,1-3H3,(H2,20,21,22,27)/b13-9-