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

Systemtic Name: N-butyl-2-[[4-oxidanylidene-5-(4-propan-2-ylphenyl)-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]ethanamide Openeye Name: N-butyl-2-[[5-(4-isopropylphenyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide CAS Name: N-butyl-2-[[4-oxo-5-(4-propan-2-ylphenyl)-3H-thieno[2,3-d]pyrimidin-2-yl]thio]acetamide IUPAC Name: N-butyl-2-[[4-oxo-5-(4-propan-2-ylphenyl)-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]acetamide Traditional Name: N-butyl-2-[(4-keto-5-p-cumenyl-3H-thieno[2,3-d]pyrimidin-2-yl)thio]acetamide Formula: C21H25N3O2S2 MolecularWeight: 415.5721

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CSC1=NC2=C(C(=CS2)C3=CC=C(C=C3)C(C)C)C(=O)N1

Isomeric SMILES

CCCCNC(=O)CSC1=NC2=C(C(=CS2)C3=CC=C(C=C3)C(C)C)C(=O)N1

InChI

InChI=1S/C21H25N3O2S2/c1-4-5-10-22-17(25)12-28-21-23-19(26)18-16(11-27-20(18)24-21)15-8-6-14(7-9-15)13(2)3/h6-9,11,13H,4-5,10,12H2,1-3H3,(H,22,25)(H,23,24,26)