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

Systemtic Name: 3-cyclohexyl-2-(7-methylsulfonyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-pyridin-2-yl-propanamide Openeye Name: 3-cyclohexyl-2-(7-methylsulfonyl-4-oxo-2-thioxo-1H-quinazolin-3-yl)-N-(2-pyridyl)propanamide CAS Name: 3-cyclohexyl-2-(7-methylsulfonyl-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-(2-pyridinyl)propanamide IUPAC Name: 3-cyclohexyl-2-(7-methylsulfonyl-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-pyridin-2-ylpropanamide Traditional Name: 3-cyclohexyl-2-(4-keto-7-mesyl-2-thioxo-1H-quinazolin-3-yl)-N-(2-pyridyl)propionamide Formula: C23H26N4O4S2 MolecularWeight: 486.60694

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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=CC=CC=N4

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)C(CC3CCCCC3)C(=O)NC4=CC=CC=N4

InChI

InChI=1S/C23H26N4O4S2/c1-33(30,31)16-10-11-17-18(14-16)25-23(32)27(22(17)29)19(13-15-7-3-2-4-8-15)21(28)26-20-9-5-6-12-24-20/h5-6,9-12,14-15,19H,2-4,7-8,13H2,1H3,(H,25,32)(H,24,26,28)