3-methylbutyl 2-(4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanoate

Systemtic Name: 3-methylbutyl 2-(4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanoate Openeye Name: isopentyl 2-(4-oxo-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetate CAS Name: 2-(4-oxo-6-phenyl-3-thieno[2,3-d]pyrimidinyl)acetic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-(4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)acetate Traditional Name: 2-(4-keto-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetic acid isoamyl ester Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)CN1C=NC2=C(C1=O)C=C(S2)C3=CC=CC=C3

Isomeric SMILES

CC(C)CCOC(=O)CN1C=NC2=C(C1=O)C=C(S2)C3=CC=CC=C3

InChI

InChI=1S/C19H20N2O3S/c1-13(2)8-9-24-17(22)11-21-12-20-18-15(19(21)23)10-16(25-18)14-6-4-3-5-7-14/h3-7,10,12-13H,8-9,11H2,1-2H3