N-(2-methylcyclohexyl)-2-[(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]ethanamide

Systemtic Name: N-(2-methylcyclohexyl)-2-[(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]ethanamide Openeye Name: N-(2-methylcyclohexyl)-2-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]acetamide CAS Name: N-(2-methylcyclohexyl)-2-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylthio]acetamide IUPAC Name: N-(2-methylcyclohexyl)-2-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]acetamide Traditional Name: 2-[(4-keto-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)methylthio]-N-(2-methylcyclohexyl)acetamide Formula: C22H25N3O2S2 MolecularWeight: 427.5828

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)CSCC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

Isomeric SMILES

CC1CCCCC1NC(=O)CSCC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

InChI

InChI=1S/C22H25N3O2S2/c1-14-7-5-6-10-17(14)23-19(26)13-28-12-18-24-21(27)20-16(11-29-22(20)25-18)15-8-3-2-4-9-15/h2-4,8-9,11,14,17H,5-7,10,12-13H2,1H3,(H,23,26)(H,24,25,27)