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

Systemtic Name: N-(4-methylcyclohexyl)-2-[(4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: N-(4-methylcyclohexyl)-2-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-(4-methylcyclohexyl)-2-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)thio]acetamide IUPAC Name: N-(4-methylcyclohexyl)-2-[(4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: 2-[(4-keto-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)thio]-N-(4-methylcyclohexyl)acetamide Formula: C21H23N3O2S2 MolecularWeight: 413.55622

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NC(=O)CSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

Isomeric SMILES

CC1CCC(CC1)NC(=O)CSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

InChI

InChI=1S/C21H23N3O2S2/c1-13-7-9-15(10-8-13)22-17(25)12-28-21-23-19(26)18-16(11-27-20(18)24-21)14-5-3-2-4-6-14/h2-6,11,13,15H,7-10,12H2,1H3,(H,22,25)(H,23,24,26)