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

Systemtic Name: 3-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide Openeye Name: 3-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide CAS Name: 3-[(3-ethyl-4-oxo-2-quinazolinyl)thio]-N-[4-(2-pyrimidinylsulfamoyl)phenyl]propanamide IUPAC Name: 3-(3-ethyl-4-oxoquinazolin-2-yl)sulfanyl-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide Traditional Name: 3-[(3-ethyl-4-keto-quinazolin-2-yl)thio]-N-[4-(2-pyrimidylsulfamoyl)phenyl]propionamide Formula: C23H22N6O4S2 MolecularWeight: 510.58858

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SCCC(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SCCC(=O)NC3=CC=C(C=C3)S(=O)(=O)NC4=NC=CC=N4

InChI

InChI=1S/C23H22N6O4S2/c1-2-29-21(31)18-6-3-4-7-19(18)27-23(29)34-15-12-20(30)26-16-8-10-17(11-9-16)35(32,33)28-22-24-13-5-14-25-22/h3-11,13-14H,2,12,15H2,1H3,(H,26,30)(H,24,25,28)