pentyl 2-[5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylethanoate

Systemtic Name: pentyl 2-[5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylethanoate Openeye Name: pentyl 2-[5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylacetate CAS Name: 2-[[5-(4-methoxyphenyl)-4-thieno[2,3-d]pyrimidinyl]thio]acetic acid pentyl ester IUPAC Name: pentyl 2-[5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylacetate Traditional Name: 2-[[5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-4-yl]thio]acetic acid amyl ester Formula: C20H22N2O3S2 MolecularWeight: 402.53028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)CSC1=NC=NC2=C1C(=CS2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCCCOC(=O)CSC1=NC=NC2=C1C(=CS2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H22N2O3S2/c1-3-4-5-10-25-17(23)12-27-20-18-16(11-26-19(18)21-13-22-20)14-6-8-15(24-2)9-7-14/h6-9,11,13H,3-5,10,12H2,1-2H3