3-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-(4-bromophenyl)-2-oxo-ethyl]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-(4-bromophenyl)-2-oxoethyl]-5-(4-methylphenyl)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-(4-bromophenyl)-2-oxoethyl]-5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-(4-bromophenyl)-2-keto-ethyl]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C21H15BrN2O2S MolecularWeight: 439.325

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H15BrN2O2S/c1-13-2-4-14(5-3-13)17-11-27-20-19(17)21(26)24(12-23-20)10-18(25)15-6-8-16(22)9-7-15/h2-9,11-12H,10H2,1H3