2-[7-chloranyl-3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[7-chloranyl-3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-[7-chloro-4-oxo-3-(p-tolyl)quinazolin-2-yl]sulfanyl-N-(4-methyl-3-morpholinosulfonyl-phenyl)acetamide CAS Name: 2-[[7-chloro-3-(4-methylphenyl)-4-oxo-2-quinazolinyl]thio]-N-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[7-chloro-3-(4-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(4-methyl-3-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-[[7-chloro-4-keto-3-(p-tolyl)quinazolin-2-yl]thio]-N-(4-methyl-3-morpholinosulfonyl-phenyl)acetamide Formula: C28H27ClN4O5S2 MolecularWeight: 599.12078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NC4=CC(=C(C=C4)C)S(=O)(=O)N5CCOCC5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NC4=CC(=C(C=C4)C)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C28H27ClN4O5S2/c1-18-3-8-22(9-4-18)33-27(35)23-10-6-20(29)15-24(23)31-28(33)39-17-26(34)30-21-7-5-19(2)25(16-21)40(36,37)32-11-13-38-14-12-32/h3-10,15-16H,11-14,17H2,1-2H3,(H,30,34)