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

Systemtic Name: 2-[5-(4-bromophenyl)-6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]-N-(4-butylphenyl)ethanamide Openeye Name: 2-[5-(4-bromophenyl)-6-ethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl]-N-(4-butylphenyl)acetamide CAS Name: 2-[5-(4-bromophenyl)-6-ethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl]-N-(4-butylphenyl)acetamide IUPAC Name: 2-[5-(4-bromophenyl)-6-ethyl-4-oxothieno[2,3-d]pyrimidin-3-yl]-N-(4-butylphenyl)acetamide Traditional Name: 2-[5-(4-bromophenyl)-6-ethyl-4-keto-thieno[2,3-d]pyrimidin-3-yl]-N-(4-butylphenyl)acetamide Formula: C26H26BrN3O2S MolecularWeight: 524.47254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)C(=C(S3)CC)C4=CC=C(C=C4)Br

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)C(=C(S3)CC)C4=CC=C(C=C4)Br

InChI

InChI=1S/C26H26BrN3O2S/c1-3-5-6-17-7-13-20(14-8-17)29-22(31)15-30-16-28-25-24(26(30)32)23(21(4-2)33-25)18-9-11-19(27)12-10-18/h7-14,16H,3-6,15H2,1-2H3,(H,29,31)