2-(1-adamantylsulfanyl)-N-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanamide

Systemtic Name: 2-(1-adamantylsulfanyl)-N-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)ethanamide Openeye Name: 2-(1-adamantylsulfanyl)-N-(5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)acetamide CAS Name: 2-(1-adamantylthio)-N-(5,6-dimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)acetamide IUPAC Name: 2-(1-adamantylsulfanyl)-N-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide Traditional Name: 2-(1-adamantylthio)-N-(4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl)acetamide Formula: C20H25N3O2S2 MolecularWeight: 403.5614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)NC(=O)CSC34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)NC(=O)CSC34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C20H25N3O2S2/c1-11-12(2)27-18-17(11)19(25)23(10-21-18)22-16(24)9-26-20-6-13-3-14(7-20)5-15(4-13)8-20/h10,13-15H,3-9H2,1-2H3,(H,22,24)