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0NS

Summary
Name:2-methoxy-N-(3-methyl-2-oxo-1,2,3,4-tetrahydroquinazolin-6-yl)benzenesulfonamide
Formula:C16 H17 N3 O4 S
Formal charge:0
Formula weight:347.389 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.012-methoxy-N-(3-methyl-2-oxo-1,2,3,4-tetrahydroquinazolin-6-yl)benzenesulfonamide
OpenEye OEToolkits1.7.62-methoxy-N-(3-methyl-2-oxidanylidene-1,4-dihydroquinazolin-6-yl)benzenesulfonamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=S(=O)(c1ccccc1OC)Nc2ccc3NC(=O)N(Cc3c2)C
InChIInChI1.03InChI=1S/C16H17N3O4S/c1-19-10-11-9-12(7-8-13(11)17-16(19)20)18-24(21,22)15-6-4-3-5-14(15)23-2/h3-9,18H,10H2,1-2H3,(H,17,20)
InChIKeyInChI1.03TXZPMHLMPKIUGK-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.370COc1ccccc1[S](=O)(=O)Nc2ccc3NC(=O)N(C)Cc3c2
SMILESCACTVS3.370COc1ccccc1[S](=O)(=O)Nc2ccc3NC(=O)N(C)Cc3c2
SMILES_CANONICALOpenEye OEToolkits1.7.6CN1Cc2cc(ccc2NC1=O)NS(=O)(=O)c3ccccc3OC
SMILESOpenEye OEToolkits1.7.6CN1Cc2cc(ccc2NC1=O)NS(=O)(=O)c3ccccc3OC

218853

PDB entries from 2024-04-24

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