3-(5,6-dimethyl-4-oxidanylidene-2-phenyl-thieno[2,3-d]pyrimidin-3-yl)propanoate

Systemtic Name: 3-(5,6-dimethyl-4-oxidanylidene-2-phenyl-thieno[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: 3-(5,6-dimethyl-4-oxo-2-phenyl-thieno[2,3-d]pyrimidin-3-yl)propanoate CAS Name: 3-(5,6-dimethyl-4-oxo-2-phenyl-3-thieno[2,3-d]pyrimidinyl)propanoate IUPAC Name: 3-(5,6-dimethyl-4-oxo-2-phenylthieno[2,3-d]pyrimidin-3-yl)propanoate Traditional Name: 3-(4-keto-5,6-dimethyl-2-phenyl-thieno[2,3-d]pyrimidin-3-yl)propionate Formula: C17H15N2O3S- MolecularWeight: 327.3776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)C3=CC=CC=C3)CCC(=O)[O-])C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)C3=CC=CC=C3)CCC(=O)[O-])C

InChI

InChI=1S/C17H16N2O3S/c1-10-11(2)23-16-14(10)17(22)19(9-8-13(20)21)15(18-16)12-6-4-3-5-7-12/h3-7H,8-9H2,1-2H3,(H,20,21)/p-1