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

Systemtic Name: 5-(4-bromophenyl)-3-[2-(3-methoxyphenyl)-2-oxidanylidene-ethyl]-6-methyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-bromophenyl)-3-[2-(3-methoxyphenyl)-2-oxo-ethyl]-6-methyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-bromophenyl)-3-[2-(3-methoxyphenyl)-2-oxoethyl]-6-methyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-bromophenyl)-3-[2-(3-methoxyphenyl)-2-oxoethyl]-6-methylthieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-bromophenyl)-3-[2-keto-2-(3-methoxyphenyl)ethyl]-6-methyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H17BrN2O3S MolecularWeight: 469.35098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=CN(C2=O)CC(=O)C3=CC(=CC=C3)OC)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(C2=C(S1)N=CN(C2=O)CC(=O)C3=CC(=CC=C3)OC)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H17BrN2O3S/c1-13-19(14-6-8-16(23)9-7-14)20-21(29-13)24-12-25(22(20)27)11-18(26)15-4-3-5-17(10-15)28-2/h3-10,12H,11H2,1-2H3