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

Systemtic Name: 3-[5-(3,4-dichlorophenyl)-2-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoate Openeye Name: 3-[5-(3,4-dichlorophenyl)-2-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl]propanoate CAS Name: 3-[5-(3,4-dichlorophenyl)-2-methyl-4-oxo-3-thieno[2,3-d]pyrimidinyl]propanoate IUPAC Name: 3-[5-(3,4-dichlorophenyl)-2-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl]propanoate Traditional Name: 3-[5-(3,4-dichlorophenyl)-4-keto-2-methyl-thieno[2,3-d]pyrimidin-3-yl]propionate Formula: C16H11Cl2N2O3S- MolecularWeight: 382.24114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12Cl2N2O3S/c1-8-19-15-14(16(23)20(8)5-4-13(21)22)10(7-24-15)9-2-3-11(17)12(18)6-9/h2-3,6-7H,4-5H2,1H3,(H,21,22)/p-1