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PQC

Summary
Name:3-[(8-phenylthieno[2,3-h]quinazolin-2-yl)amino]benzenesulfonamide
Formula:C22 H16 N4 O2 S2
Formal charge:0
Formula weight:432.518 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.013-[(8-phenylthieno[2,3-h]quinazolin-2-yl)amino]benzenesulfonamide
OpenEye OEToolkits1.7.23-[(8-phenylthieno[2,3-h]quinazolin-2-yl)amino]benzenesulfonamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=S(=O)(N)c1cccc(c1)Nc2nc4c(cn2)ccc3sc(cc34)c5ccccc5
SMILES_CANONICALCACTVS3.370N[S](=O)(=O)c1cccc(Nc2ncc3ccc4sc(cc4c3n2)c5ccccc5)c1
SMILESCACTVS3.370N[S](=O)(=O)c1cccc(Nc2ncc3ccc4sc(cc4c3n2)c5ccccc5)c1
SMILES_CANONICALOpenEye OEToolkits1.7.2c1ccc(cc1)c2cc3c(s2)ccc4c3nc(nc4)Nc5cccc(c5)S(=O)(=O)N
SMILESOpenEye OEToolkits1.7.2c1ccc(cc1)c2cc3c(s2)ccc4c3nc(nc4)Nc5cccc(c5)S(=O)(=O)N
InChIInChI1.03InChI=1S/C22H16N4O2S2/c23-30(27,28)17-8-4-7-16(11-17)25-22-24-13-15-9-10-19-18(21(15)26-22)12-20(29-19)14-5-2-1-3-6-14/h1-13H,(H2,23,27,28)(H,24,25,26)
InChIKeyInChI1.03ZSSGEBJSMMYEMX-UHFFFAOYSA-N

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건을2024-07-24부터공개중

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