N-(4-bromophenyl)-2-[6-methyl-5-(4-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[6-methyl-5-(4-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanamide Openeye Name: N-(4-bromophenyl)-2-[6-methyl-4-oxo-5-(p-tolyl)thieno[2,3-d]pyrimidin-3-yl]acetamide CAS Name: N-(4-bromophenyl)-2-[6-methyl-5-(4-methylphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetamide IUPAC Name: N-(4-bromophenyl)-2-[6-methyl-5-(4-methylphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]acetamide Traditional Name: N-(4-bromophenyl)-2-[4-keto-6-methyl-5-(p-tolyl)thieno[2,3-d]pyrimidin-3-yl]acetamide Formula: C22H18BrN3O2S MolecularWeight: 468.36622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC3=C2C(=O)N(C=N3)CC(=O)NC4=CC=C(C=C4)Br)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC3=C2C(=O)N(C=N3)CC(=O)NC4=CC=C(C=C4)Br)C

InChI

InChI=1S/C22H18BrN3O2S/c1-13-3-5-15(6-4-13)19-14(2)29-21-20(19)22(28)26(12-24-21)11-18(27)25-17-9-7-16(23)8-10-17/h3-10,12H,11H2,1-2H3,(H,25,27)