methyl (Z)-3-(4-tert-butylphenyl)-2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)prop-2-enoate

Systemtic Name: methyl (Z)-3-(4-tert-butylphenyl)-2-(4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)prop-2-enoate Openeye Name: methyl (Z)-3-(4-tert-butylphenyl)-2-(4-oxo-2-thioxo-1H-pyrimidin-6-yl)prop-2-enoate CAS Name: (Z)-3-(4-tert-butylphenyl)-2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-3-(4-tert-butylphenyl)-2-(4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)prop-2-enoate Traditional Name: (Z)-3-(4-tert-butylphenyl)-2-(4-keto-2-thioxo-1H-pyrimidin-6-yl)acrylic acid methyl ester Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O3S/c1-18(2,3)12-7-5-11(6-8-12)9-13(16(22)23-4)14-10-15(21)20-17(24)19-14/h5-10H,1-4H3,(H2,19,20,21,24)/b13-9-