(phenylmethyl) 2-[3-(4-methoxyphenyl)-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl]sulfanylethanoate

Systemtic Name: (phenylmethyl) 2-[3-(4-methoxyphenyl)-4-oxidanylidene-thieno[3,2-d]pyrimidin-2-yl]sulfanylethanoate Openeye Name: benzyl 2-[3-(4-methoxyphenyl)-4-oxo-thieno[3,2-d]pyrimidin-2-yl]sulfanylacetate CAS Name: 2-[[3-(4-methoxyphenyl)-4-oxo-2-thieno[3,2-d]pyrimidinyl]thio]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[3-(4-methoxyphenyl)-4-oxothieno[3,2-d]pyrimidin-2-yl]sulfanylacetate Traditional Name: 2-[[4-keto-3-(4-methoxyphenyl)thieno[3,2-d]pyrimidin-2-yl]thio]acetic acid benzyl ester Formula: C22H18N2O4S2 MolecularWeight: 438.51932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3=C(C=CS3)N=C2SCC(=O)OCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=C(C=CS3)N=C2SCC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C22H18N2O4S2/c1-27-17-9-7-16(8-10-17)24-21(26)20-18(11-12-29-20)23-22(24)30-14-19(25)28-13-15-5-3-2-4-6-15/h2-12H,13-14H2,1H3