N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-[4-[(5-methylisoxazol-3-yl)sulfamoyl]phenyl]-2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-[4-[(5-methyl-3-isoxazolyl)sulfamoyl]phenyl]-2-[(3-methyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-2-(3-methyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: 2-[(4-keto-3-methyl-quinazolin-2-yl)thio]-N-[4-[(5-methylisoxazol-3-yl)sulfamoyl]phenyl]propionamide Formula: C22H21N5O5S2 MolecularWeight: 499.56264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C(C)SC3=NC4=CC=CC=C4C(=O)N3C

Isomeric SMILES

CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C(C)SC3=NC4=CC=CC=C4C(=O)N3C

InChI

InChI=1S/C22H21N5O5S2/c1-13-12-19(25-32-13)26-34(30,31)16-10-8-15(9-11-16)23-20(28)14(2)33-22-24-18-7-5-4-6-17(18)21(29)27(22)3/h4-12,14H,1-3H3,(H,23,28)(H,25,26)