2-methylpropyl 2-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylethanoate

Systemtic Name: 2-methylpropyl 2-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylethanoate Openeye Name: isobutyl 2-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylacetate CAS Name: 2-[[5-(4-chlorophenyl)-4-thieno[2,3-d]pyrimidinyl]thio]acetic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylacetate Traditional Name: 2-[[5-(4-chlorophenyl)thieno[2,3-d]pyrimidin-4-yl]thio]acetic acid isobutyl ester Formula: C18H17ClN2O2S2 MolecularWeight: 392.92278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)CSC1=NC=NC2=C1C(=CS2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)COC(=O)CSC1=NC=NC2=C1C(=CS2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H17ClN2O2S2/c1-11(2)7-23-15(22)9-25-18-16-14(8-24-17(16)20-10-21-18)12-3-5-13(19)6-4-12/h3-6,8,10-11H,7,9H2,1-2H3