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Summary

Name:3-{[(4-methylphenyl)sulfonyl]amino}propyl pyridin-4-ylcarbamate
Formula:C16 H19 N3 O4 S
Formal charge:0
Molecular weight:349.405 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs10.043-{[(4-methylphenyl)sulfonyl]amino}propyl pyridin-4-ylcarbamate
OpenEye OEToolkits1.5.03-[(4-methylphenyl)sulfonylamino]propyl N-pyridin-4-ylcarbamate

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(OCCCNS(=O)(=O)c1ccc(cc1)C)Nc2ccncc2
SMILES_CANONICALCACTVS3.341Cc1ccc(cc1)[S](=O)(=O)NCCCOC(=O)Nc2ccncc2
SMILESCACTVS3.341Cc1ccc(cc1)[S](=O)(=O)NCCCOC(=O)Nc2ccncc2
SMILES_CANONICALOpenEye OEToolkits1.5.0Cc1ccc(cc1)S(=O)(=O)NCCCOC(=O)Nc2ccncc2
SMILESOpenEye OEToolkits1.5.0Cc1ccc(cc1)S(=O)(=O)NCCCOC(=O)Nc2ccncc2
InChIInChI1.03InChI=1S/C16H19N3O4S/c1-13-3-5-15(6-4-13)24(21,22)18-9-2-12-23-16(20)19-14-7-10-17-11-8-14/h3-8,10-11,18H,2,9,12H2,1H3,(H,17,19,20)
InChIKeyInChI1.03ITYCDQJBLCTIID-UHFFFAOYSA-N