methyl 3-[(3-methyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl)sulfanylmethyl]benzoate

Systemtic Name: methyl 3-[(3-methyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl)sulfanylmethyl]benzoate Openeye Name: methyl 3-[(3-methyl-4-oxo-thieno[3,2-d]pyrimidin-2-yl)sulfanylmethyl]benzoate CAS Name: 3-[[(3-methyl-4-oxo-2-thieno[3,2-d]pyrimidinyl)thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(3-methyl-4-oxothieno[3,2-d]pyrimidin-2-yl)sulfanylmethyl]benzoate Traditional Name: 3-[[(4-keto-3-methyl-thieno[3,2-d]pyrimidin-2-yl)thio]methyl]benzoic acid methyl ester Formula: C16H14N2O3S2 MolecularWeight: 346.42396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C=CS2)N=C1SCC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

CN1C(=O)C2=C(C=CS2)N=C1SCC3=CC=CC(=C3)C(=O)OC

InChI

InChI=1S/C16H14N2O3S2/c1-18-14(19)13-12(6-7-22-13)17-16(18)23-9-10-4-3-5-11(8-10)15(20)21-2/h3-8H,9H2,1-2H3