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

Systemtic Name: 3-(2-methyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: 3-(2-methyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propanoate CAS Name: 3-(2-methyl-4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)propanoate IUPAC Name: 3-(2-methyl-4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)propanoate Traditional Name: 3-(4-keto-2-methyl-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)propionate Formula: C16H13N2O3S- MolecularWeight: 313.35102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1CCC(=O)[O-]

Isomeric SMILES

CC1=NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)N1CCC(=O)[O-]

InChI

InChI=1S/C16H14N2O3S/c1-10-17-15-14(16(21)18(10)8-7-13(19)20)12(9-22-15)11-5-3-2-4-6-11/h2-6,9H,7-8H2,1H3,(H,19,20)/p-1