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

Systemtic Name: 3-[5-(4-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]-N-pentyl-propanamide Openeye Name: 3-[4-oxo-5-(p-tolyl)thieno[2,3-d]pyrimidin-3-yl]-N-pentyl-propanamide CAS Name: 3-[5-(4-methylphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]-N-pentylpropanamide IUPAC Name: 3-[5-(4-methylphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]-N-pentylpropanamide Traditional Name: N-amyl-3-[4-keto-5-(p-tolyl)thieno[2,3-d]pyrimidin-3-yl]propionamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)CCN1C=NC2=C(C1=O)C(=CS2)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCCNC(=O)CCN1C=NC2=C(C1=O)C(=CS2)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H25N3O2S/c1-3-4-5-11-22-18(25)10-12-24-14-23-20-19(21(24)26)17(13-27-20)16-8-6-15(2)7-9-16/h6-9,13-14H,3-5,10-12H2,1-2H3,(H,22,25)