2-(4-azanylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-phenylbutyl)ethanamide

Systemtic Name: 2-(4-azanylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-phenylbutyl)ethanamide Openeye Name: 2-(4-aminothieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-phenylbutyl)acetamide CAS Name: 2-[(4-amino-2-thieno[2,3-d]pyrimidinyl)thio]-N-(2-phenylbutyl)acetamide IUPAC Name: 2-(4-aminothieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(2-phenylbutyl)acetamide Traditional Name: 2-[(4-aminothieno[2,3-d]pyrimidin-2-yl)thio]-N-(2-phenylbutyl)acetamide Formula: C18H20N4OS2 MolecularWeight: 372.5076

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)CSC1=NC(=C2C=CSC2=N1)N)C3=CC=CC=C3

Isomeric SMILES

CCC(CNC(=O)CSC1=NC(=C2C=CSC2=N1)N)C3=CC=CC=C3

InChI

InChI=1S/C18H20N4OS2/c1-2-12(13-6-4-3-5-7-13)10-20-15(23)11-25-18-21-16(19)14-8-9-24-17(14)22-18/h3-9,12H,2,10-11H2,1H3,(H,20,23)(H2,19,21,22)