N-butyl-2-[4-oxidanylidene-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-3-yl]ethanamide

Systemtic Name: N-butyl-2-[4-oxidanylidene-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-3-yl]ethanamide Openeye Name: N-butyl-2-[5-(4-isopropylphenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]acetamide CAS Name: N-butyl-2-[4-oxo-5-(4-propan-2-ylphenyl)-3-thieno[2,3-d]pyrimidinyl]acetamide IUPAC Name: N-butyl-2-[4-oxo-5-(4-propan-2-ylphenyl)thieno[2,3-d]pyrimidin-3-yl]acetamide Traditional Name: N-butyl-2-(4-keto-5-p-cumenyl-thieno[2,3-d]pyrimidin-3-yl)acetamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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