4-[(2-bromanylphenoxy)methyl]-N-(2,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)benzamide

Systemtic Name: 4-[(2-bromanylphenoxy)methyl]-N-(2,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)benzamide Openeye Name: 4-[(2-bromophenoxy)methyl]-N-(2,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)benzamide CAS Name: 4-[(2-bromophenoxy)methyl]-N-(2,6-dimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)benzamide IUPAC Name: 4-[(2-bromophenoxy)methyl]-N-(2,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)benzamide Traditional Name: 4-[(2-bromophenoxy)methyl]-N-(4-keto-2,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl)benzamide Formula: C22H18BrN3O3S MolecularWeight: 484.36562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(S1)N=C(N(C2=O)NC(=O)C3=CC=C(C=C3)COC4=CC=CC=C4Br)C

Isomeric SMILES

CC1=CC2=C(S1)N=C(N(C2=O)NC(=O)C3=CC=C(C=C3)COC4=CC=CC=C4Br)C

InChI

InChI=1S/C22H18BrN3O3S/c1-13-11-17-21(30-13)24-14(2)26(22(17)28)25-20(27)16-9-7-15(8-10-16)12-29-19-6-4-3-5-18(19)23/h3-11H,12H2,1-2H3,(H,25,27)