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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=C(C=C4)C)Cl)S(=O)(=O)N5CCOCC5

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC(=C(C=C4)C)Cl)S(=O)(=O)N5CCOCC5

InChI

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