2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide

Systemtic Name: 2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide Openeye Name: 2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide CAS Name: 2-[(3-methyl-4-oxo-2-quinazolinyl)thio]-N-[4-(2-pyrimidinylsulfamoyl)phenyl]propanamide IUPAC Name: 2-(3-methyl-4-oxoquinazolin-2-yl)sulfanyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide Traditional Name: 2-[(4-keto-3-methyl-quinazolin-2-yl)thio]-N-[4-(2-pyrimidylsulfamoyl)phenyl]propionamide Formula: C22H20N6O4S2 MolecularWeight: 496.562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC=N2)SC3=NC4=CC=CC=C4C(=O)N3C

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC=N2)SC3=NC4=CC=CC=C4C(=O)N3C

InChI

InChI=1S/C22H20N6O4S2/c1-14(33-22-26-18-7-4-3-6-17(18)20(30)28(22)2)19(29)25-15-8-10-16(11-9-15)34(31,32)27-21-23-12-5-13-24-21/h3-14H,1-2H3,(H,25,29)(H,23,24,27)