2-(3-butan-2-yl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-methyl-N-(4-methylcyclohexyl)ethanamide

Systemtic Name: 2-(3-butan-2-yl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-methyl-N-(4-methylcyclohexyl)ethanamide Openeye Name: N-methyl-N-(4-methylcyclohexyl)-2-(4-oxo-3-sec-butyl-quinazolin-2-yl)sulfanyl-acetamide CAS Name: 2-[(3-butan-2-yl-4-oxo-2-quinazolinyl)thio]-N-methyl-N-(4-methylcyclohexyl)acetamide IUPAC Name: 2-(3-butan-2-yl-4-oxoquinazolin-2-yl)sulfanyl-N-methyl-N-(4-methylcyclohexyl)acetamide Traditional Name: 2-[(4-keto-3-sec-butyl-quinazolin-2-yl)thio]-N-methyl-N-(4-methylcyclohexyl)acetamide Formula: C22H31N3O2S MolecularWeight: 401.56544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C)C3CCC(CC3)C

Isomeric SMILES

CCC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C)C3CCC(CC3)C

InChI

InChI=1S/C22H31N3O2S/c1-5-16(3)25-21(27)18-8-6-7-9-19(18)23-22(25)28-14-20(26)24(4)17-12-10-15(2)11-13-17/h6-9,15-17H,5,10-14H2,1-4H3