N-[[4-(diethylsulfamoyl)phenyl]methyl]-2-quinazolin-4-ylsulfanyl-ethanamide

Systemtic Name: N-[[4-(diethylsulfamoyl)phenyl]methyl]-2-quinazolin-4-ylsulfanyl-ethanamide Openeye Name: N-[[4-(diethylsulfamoyl)phenyl]methyl]-2-quinazolin-4-ylsulfanyl-acetamide CAS Name: N-[[4-(diethylsulfamoyl)phenyl]methyl]-2-(4-quinazolinylthio)acetamide IUPAC Name: N-[[4-(diethylsulfamoyl)phenyl]methyl]-2-quinazolin-4-ylsulfanylacetamide Traditional Name: N-[4-(diethylsulfamoyl)benzyl]-2-(quinazolin-4-ylthio)acetamide Formula: C21H24N4O3S2 MolecularWeight: 444.57026

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)CNC(=O)CSC2=NC=NC3=CC=CC=C32

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)CNC(=O)CSC2=NC=NC3=CC=CC=C32

InChI

InChI=1S/C21H24N4O3S2/c1-3-25(4-2)30(27,28)17-11-9-16(10-12-17)13-22-20(26)14-29-21-18-7-5-6-8-19(18)23-15-24-21/h5-12,15H,3-4,13-14H2,1-2H3,(H,22,26)