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

Systemtic Name: [5-(2-chlorophenyl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]methyl pentanoate Openeye Name: [5-(2-chlorophenyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]methyl pentanoate CAS Name: pentanoic acid [5-(2-chlorophenyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]methyl ester IUPAC Name: [5-(2-chlorophenyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]methyl pentanoate Traditional Name: valeric acid [5-(2-chlorophenyl)-4-keto-3H-thieno[2,3-d]pyrimidin-2-yl]methyl ester Formula: C18H17ClN2O3S MolecularWeight: 376.85718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OCC1=NC2=C(C(=CS2)C3=CC=CC=C3Cl)C(=O)N1

Isomeric SMILES

CCCCC(=O)OCC1=NC2=C(C(=CS2)C3=CC=CC=C3Cl)C(=O)N1

InChI

InChI=1S/C18H17ClN2O3S/c1-2-3-8-15(22)24-9-14-20-17(23)16-12(10-25-18(16)21-14)11-6-4-5-7-13(11)19/h4-7,10H,2-3,8-9H2,1H3,(H,20,21,23)