ethyl 2-[5-(4-bromophenyl)-6-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]butanoate

Systemtic Name: ethyl 2-[5-(4-bromophenyl)-6-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]butanoate Openeye Name: ethyl 2-[5-(4-bromophenyl)-6-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl]butanoate CAS Name: 2-[5-(4-bromophenyl)-6-methyl-4-oxo-3-thieno[2,3-d]pyrimidinyl]butanoic acid ethyl ester IUPAC Name: ethyl 2-[5-(4-bromophenyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl]butanoate Traditional Name: 2-[5-(4-bromophenyl)-4-keto-6-methyl-thieno[2,3-d]pyrimidin-3-yl]butyric acid ethyl ester Formula: C19H19BrN2O3S MolecularWeight: 435.33476

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC)N1C=NC2=C(C1=O)C(=C(S2)C)C3=CC=C(C=C3)Br

Isomeric SMILES

CCC(C(=O)OCC)N1C=NC2=C(C1=O)C(=C(S2)C)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H19BrN2O3S/c1-4-14(19(24)25-5-2)22-10-21-17-16(18(22)23)15(11(3)26-17)12-6-8-13(20)9-7-12/h6-10,14H,4-5H2,1-3H3