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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)Br

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H18BrN3O2S/c1-25(11-15-5-3-2-4-6-15)19(27)12-26-14-24-21-20(22(26)28)18(13-29-21)16-7-9-17(23)10-8-16/h2-10,13-14H,11-12H2,1H3