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BL1

Summary
Name:4-chloro-N-[(2S)-2-methyl-2,3-dihydro-1H-indol-1-yl]-3-sulfamoylbenzamide
Synonyms:Indapamide
Formula:C16 H16 Cl N3 O3 S
Formal charge:0
Formula weight:365.835 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.044-chloro-N-[(2S)-2-methyl-2,3-dihydro-1H-indol-1-yl]-3-sulfamoylbenzamide
OpenEye OEToolkits1.5.04-chloro-N-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-3-sulfamoyl-benzamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=S(=O)(N)c1c(Cl)ccc(c1)C(=O)NN3c2ccccc2CC3C
SMILES_CANONICALCACTVS3.341C[C@H]1Cc2ccccc2N1NC(=O)c3ccc(Cl)c(c3)[S](N)(=O)=O
SMILESCACTVS3.341C[CH]1Cc2ccccc2N1NC(=O)c3ccc(Cl)c(c3)[S](N)(=O)=O
SMILES_CANONICALOpenEye OEToolkits1.5.0C[C@H]1Cc2ccccc2N1NC(=O)c3ccc(c(c3)S(=O)(=O)N)Cl
SMILESOpenEye OEToolkits1.5.0CC1Cc2ccccc2N1NC(=O)c3ccc(c(c3)S(=O)(=O)N)Cl
InChIInChI1.03InChI=1S/C16H16ClN3O3S/c1-10-8-11-4-2-3-5-14(11)20(10)19-16(21)12-6-7-13(17)15(9-12)24(18,22)23/h2-7,9-10H,8H2,1H3,(H,19,21)(H2,18,22,23)/t10-/m0/s1
InChIKeyInChI1.03NDDAHWYSQHTHNT-JTQLQIEISA-N

220472

PDB entries from 2024-05-29

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