tert-butyl 2-[6-(4-bromophenyl)-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl]ethanoate

Systemtic Name: tert-butyl 2-[6-(4-bromophenyl)-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl]ethanoate Openeye Name: tert-butyl 2-[6-(4-bromophenyl)-4-oxo-thieno[3,2-d]pyrimidin-3-yl]acetate CAS Name: 2-[6-(4-bromophenyl)-4-oxo-3-thieno[3,2-d]pyrimidinyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[6-(4-bromophenyl)-4-oxothieno[3,2-d]pyrimidin-3-yl]acetate Traditional Name: 2-[6-(4-bromophenyl)-4-keto-thieno[3,2-d]pyrimidin-3-yl]acetic acid tert-butyl ester Formula: C18H17BrN2O3S MolecularWeight: 421.30818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1C=NC2=C(C1=O)SC(=C2)C3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)(C)OC(=O)CN1C=NC2=C(C1=O)SC(=C2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H17BrN2O3S/c1-18(2,3)24-15(22)9-21-10-20-13-8-14(25-16(13)17(21)23)11-4-6-12(19)7-5-11/h4-8,10H,9H2,1-3H3