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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)CN1C=NC2=C(C1=O)C(=CS2)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCNC(=O)NC(=O)CN1C=NC2=C(C1=O)C(=CS2)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H22N4O3S/c1-3-4-9-21-20(27)23-16(25)10-24-12-22-18-17(19(24)26)15(11-28-18)14-7-5-13(2)6-8-14/h5-8,11-12H,3-4,9-10H2,1-2H3,(H2,21,23,25,27)