2-[[5-(4-chlorophenyl)-6-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[5-(4-chlorophenyl)-6-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]ethanoate Openeye Name: 2-[[5-(4-chlorophenyl)-6-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]acetate CAS Name: 2-[[5-(4-chlorophenyl)-6-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]thio]acetate IUPAC Name: 2-[[5-(4-chlorophenyl)-6-methyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-(4-chlorophenyl)-4-keto-6-methyl-3H-thieno[2,3-d]pyrimidin-2-yl]thio]acetate Formula: C15H10ClN2O3S2- MolecularWeight: 365.8345

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=C(NC2=O)SCC(=O)[O-])C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C2=C(S1)N=C(NC2=O)SCC(=O)[O-])C3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H11ClN2O3S2/c1-7-11(8-2-4-9(16)5-3-8)12-13(21)17-15(18-14(12)23-7)22-6-10(19)20/h2-5H,6H2,1H3,(H,19,20)(H,17,18,21)/p-1