(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl (E)-3-(4-methylphenyl)prop-2-enoate

Systemtic Name: (4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl (E)-3-(4-methylphenyl)prop-2-enoate Openeye Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl (E)-3-(p-tolyl)prop-2-enoate CAS Name: (E)-3-(4-methylphenyl)-2-propenoic acid (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl (E)-3-(4-methylphenyl)prop-2-enoate Traditional Name: (E)-3-(p-tolyl)acrylic acid (4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester Formula: C17H14N2O3S MolecularWeight: 326.36966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)OCC2=NC(=O)C3=C(N2)C=CS3

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)OCC2=NC(=O)C3=C(N2)C=CS3

InChI

InChI=1S/C17H14N2O3S/c1-11-2-4-12(5-3-11)6-7-15(20)22-10-14-18-13-8-9-23-16(13)17(21)19-14/h2-9H,10H2,1H3,(H,18,19,21)/b7-6+