N-butan-2-yl-2-[5,6-dimethyl-4-oxidanylidene-3-(phenylmethyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-butan-2-yl-2-[5,6-dimethyl-4-oxidanylidene-3-(phenylmethyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: 2-(3-benzyl-5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-sec-butyl-acetamide CAS Name: N-butan-2-yl-2-[[5,6-dimethyl-4-oxo-3-(phenylmethyl)-2-thieno[2,3-d]pyrimidinyl]thio]acetamide IUPAC Name: 2-(3-benzyl-5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-butan-2-ylacetamide Traditional Name: 2-[(3-benzyl-4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)thio]-N-sec-butyl-acetamide Formula: C21H25N3O2S2 MolecularWeight: 415.5721

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CSC1=NC2=C(C(=C(S2)C)C)C(=O)N1CC3=CC=CC=C3

Isomeric SMILES

CCC(C)NC(=O)CSC1=NC2=C(C(=C(S2)C)C)C(=O)N1CC3=CC=CC=C3

InChI

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