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

Systemtic Name: 2-[5-(4-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]-N-(2-methylpropylcarbamoyl)ethanamide Openeye Name: N-(isobutylcarbamoyl)-2-[4-oxo-5-(p-tolyl)thieno[2,3-d]pyrimidin-3-yl]acetamide CAS Name: 2-[5-(4-methylphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]-N-[(2-methylpropylamino)-oxomethyl]acetamide IUPAC Name: 2-[5-(4-methylphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]-N-(2-methylpropylcarbamoyl)acetamide Traditional Name: N-(isobutylcarbamoyl)-2-[4-keto-5-(p-tolyl)thieno[2,3-d]pyrimidin-3-yl]acetamide Formula: C20H22N4O3S MolecularWeight: 398.47868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(=O)NC(=O)NCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CC(=O)NC(=O)NCC(C)C

InChI

InChI=1S/C20H22N4O3S/c1-12(2)8-21-20(27)23-16(25)9-24-11-22-18-17(19(24)26)15(10-28-18)14-6-4-13(3)5-7-14/h4-7,10-12H,8-9H2,1-3H3,(H2,21,23,25,27)