2-[3-[(4-methylphenyl)sulfonylamino]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[2-(4-sulfamoylphenyl)ethyl]ethanamide

Systemtic Name: 2-[3-[(4-methylphenyl)sulfonylamino]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[2-(4-sulfamoylphenyl)ethyl]ethanamide Openeye Name: 2-[4-oxo-3-(p-tolylsulfonylamino)quinazolin-2-yl]sulfanyl-N-[2-(4-sulfamoylphenyl)ethyl]acetamide CAS Name: 2-[[3-[(4-methylphenyl)sulfonylamino]-4-oxo-2-quinazolinyl]thio]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide IUPAC Name: 2-[3-[(4-methylphenyl)sulfonylamino]-4-oxoquinazolin-2-yl]sulfanyl-N-[2-(4-sulfamoylphenyl)ethyl]acetamide Traditional Name: 2-[[4-keto-3-(tosylamino)quinazolin-2-yl]thio]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide Formula: C25H25N5O6S3 MolecularWeight: 587.6909

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCCC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCCC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C25H25N5O6S3/c1-17-6-10-20(11-7-17)39(35,36)29-30-24(32)21-4-2-3-5-22(21)28-25(30)37-16-23(31)27-15-14-18-8-12-19(13-9-18)38(26,33)34/h2-13,29H,14-16H2,1H3,(H,27,31)(H2,26,33,34)