N-(4-bromanyl-2-methyl-phenyl)-2-[6-(4-methylpiperidin-1-yl)sulfonyl-4-oxidanylidene-quinazolin-3-yl]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[6-(4-methylpiperidin-1-yl)sulfonyl-4-oxidanylidene-quinazolin-3-yl]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[6-[(4-methyl-1-piperidyl)sulfonyl]-4-oxo-quinazolin-3-yl]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[6-[(4-methyl-1-piperidinyl)sulfonyl]-4-oxo-3-quinazolinyl]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[6-(4-methylpiperidin-1-yl)sulfonyl-4-oxoquinazolin-3-yl]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[4-keto-6-(4-methylpiperidino)sulfonyl-quinazolin-3-yl]acetamide Formula: C23H25BrN4O4S MolecularWeight: 533.438

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=CN(C3=O)CC(=O)NC4=C(C=C(C=C4)Br)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=CN(C3=O)CC(=O)NC4=C(C=C(C=C4)Br)C

InChI

InChI=1S/C23H25BrN4O4S/c1-15-7-9-28(10-8-15)33(31,32)18-4-6-21-19(12-18)23(30)27(14-25-21)13-22(29)26-20-5-3-17(24)11-16(20)2/h3-6,11-12,14-15H,7-10,13H2,1-2H3,(H,26,29)