4-[2-(7-chloranyl-3-cyclohexyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoylamino]benzamide

Systemtic Name: 4-[2-(7-chloranyl-3-cyclohexyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoylamino]benzamide Openeye Name: 4-[[2-(7-chloro-3-cyclohexyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino]benzamide CAS Name: 4-[[2-[(7-chloro-3-cyclohexyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: 4-[[2-(7-chloro-3-cyclohexyl-4-oxoquinazolin-2-yl)sulfanylacetyl]amino]benzamide Traditional Name: 4-[[2-[(7-chloro-3-cyclohexyl-4-keto-quinazolin-2-yl)thio]acetyl]amino]benzamide Formula: C23H23ClN4O3S MolecularWeight: 470.97172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NC4=CC=C(C=C4)C(=O)N

Isomeric SMILES

C1CCC(CC1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NC4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C23H23ClN4O3S/c24-15-8-11-18-19(12-15)27-23(28(22(18)31)17-4-2-1-3-5-17)32-13-20(29)26-16-9-6-14(7-10-16)21(25)30/h6-12,17H,1-5,13H2,(H2,25,30)(H,26,29)