(4-bromophenyl) 2-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanoate

Systemtic Name: (4-bromophenyl) 2-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanoate Openeye Name: (4-bromophenyl) 2-(5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)acetate CAS Name: 2-(5,6-dimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)acetic acid (4-bromophenyl) ester IUPAC Name: (4-bromophenyl) 2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)acetate Traditional Name: 2-(4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl)acetic acid (4-bromophenyl) ester Formula: C16H13BrN2O3S MolecularWeight: 393.25502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)OC3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)OC3=CC=C(C=C3)Br)C

InChI

InChI=1S/C16H13BrN2O3S/c1-9-10(2)23-15-14(9)16(21)19(8-18-15)7-13(20)22-12-5-3-11(17)4-6-12/h3-6,8H,7H2,1-2H3