butan-2-yl 2-[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylethanoate

Systemtic Name: butan-2-yl 2-[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylethanoate Openeye Name: sec-butyl 2-[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylacetate CAS Name: 2-[[5-(4-bromophenyl)-4-thieno[2,3-d]pyrimidinyl]thio]acetic acid butan-2-yl ester IUPAC Name: butan-2-yl 2-[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylacetate Traditional Name: 2-[[5-(4-bromophenyl)thieno[2,3-d]pyrimidin-4-yl]thio]acetic acid sec-butyl ester Formula: C18H17BrN2O2S2 MolecularWeight: 437.37378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17BrN2O2S2/c1-3-11(2)23-15(22)9-25-18-16-14(8-24-17(16)20-10-21-18)12-4-6-13(19)7-5-12/h4-8,10-11H,3,9H2,1-2H3