4-[(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]-N-phenethyl-cyclohexane-1-carboxamide

Systemtic Name: 4-[(4-oxidanylidene-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]-N-phenethyl-cyclohexane-1-carboxamide Openeye Name: 4-[(4-oxo-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]-N-phenethyl-cyclohexanecarboxamide CAS Name: 4-[(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]-N-phenethyl-1-cyclohexanecarboxamide IUPAC Name: 4-[(4-oxo-2-sulfanylidene-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]-N-phenethylcyclohexane-1-carboxamide Traditional Name: 4-[(4-keto-2-thioxo-1H-thieno[3,2-d]pyrimidin-3-yl)methyl]-N-phenethyl-cyclohexanecarboxamide Formula: C22H25N3O2S2 MolecularWeight: 427.5828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN2C(=O)C3=C(C=CS3)NC2=S)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1CC(CCC1CN2C(=O)C3=C(C=CS3)NC2=S)C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C22H25N3O2S2/c26-20(23-12-10-15-4-2-1-3-5-15)17-8-6-16(7-9-17)14-25-21(27)19-18(11-13-29-19)24-22(25)28/h1-5,11,13,16-17H,6-10,12,14H2,(H,23,26)(H,24,28)