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31F

Summary
Name:4-(4-oxidanylidene-3H-quinazolin-2-yl)benzenesulfonamide
Formula:C14 H11 N3 O3 S
Formal charge:0
Formula weight:301.32 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.014-(4-oxo-3,4-dihydroquinazolin-2-yl)benzenesulfonamide
OpenEye OEToolkits1.9.24-(4-oxidanylidene-3H-quinazolin-2-yl)benzenesulfonamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=S(=O)(N)c3ccc(C2=Nc1c(cccc1)C(=O)N2)cc3
InChIInChI1.03InChI=1S/C14H11N3O3S/c15-21(19,20)10-7-5-9(6-8-10)13-16-12-4-2-1-3-11(12)14(18)17-13/h1-8H,(H2,15,19,20)(H,16,17,18)
InChIKeyInChI1.03OMUIDCNIRWVPSK-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385N[S](=O)(=O)c1ccc(cc1)C2=Nc3ccccc3C(=O)N2
SMILESCACTVS3.385N[S](=O)(=O)c1ccc(cc1)C2=Nc3ccccc3C(=O)N2
SMILES_CANONICALOpenEye OEToolkits1.9.2c1ccc2c(c1)C(=O)NC(=N2)c3ccc(cc3)S(=O)(=O)N
SMILESOpenEye OEToolkits1.9.2c1ccc2c(c1)C(=O)NC(=N2)c3ccc(cc3)S(=O)(=O)N

222415

數據於2024-07-10公開中

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