3-cyclohexyl-2-(7-methylsulfonyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-(1,3-thiazol-2-yl)propanamide

Systemtic Name: 3-cyclohexyl-2-(7-methylsulfonyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-(1,3-thiazol-2-yl)propanamide Openeye Name: 3-cyclohexyl-2-(7-methylsulfonyl-4-oxo-2-thioxo-1H-quinazolin-3-yl)-N-thiazol-2-yl-propanamide CAS Name: 3-cyclohexyl-2-(7-methylsulfonyl-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-(2-thiazolyl)propanamide IUPAC Name: 3-cyclohexyl-2-(7-methylsulfonyl-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-(1,3-thiazol-2-yl)propanamide Traditional Name: 3-cyclohexyl-2-(4-keto-7-mesyl-2-thioxo-1H-quinazolin-3-yl)-N-thiazol-2-yl-propionamide Formula: C21H24N4O4S3 MolecularWeight: 492.63466

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)C(CC3CCCCC3)C(=O)NC4=NC=CS4

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)C(CC3CCCCC3)C(=O)NC4=NC=CS4

InChI

InChI=1S/C21H24N4O4S3/c1-32(28,29)14-7-8-15-16(12-14)23-21(30)25(19(15)27)17(11-13-5-3-2-4-6-13)18(26)24-20-22-9-10-31-20/h7-10,12-13,17H,2-6,11H2,1H3,(H,23,30)(H,22,24,26)