N-[[1-(dimethylamino)cycloheptyl]methyl]-3-methyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-3-methyl-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-3-methyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-3-methyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-3-methyl-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-[[1-(dimethylamino)cycloheptyl]methyl]-4-keto-3-methyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C20H28N4O2S MolecularWeight: 388.52692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3(CCCCCC3)N(C)C)NC1=S

Isomeric SMILES

CN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3(CCCCCC3)N(C)C)NC1=S

InChI

InChI=1S/C20H28N4O2S/c1-23(2)20(10-6-4-5-7-11-20)13-21-17(25)14-8-9-15-16(12-14)22-19(27)24(3)18(15)26/h8-9,12H,4-7,10-11,13H2,1-3H3,(H,21,25)(H,22,27)