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LZE

Summary
Name:4-{[(2,6-dichlorophenyl)carbonyl]amino}-N-piperidin-4-yl-1H-pyrazole-3-carboxamide
Formula:C16 H17 Cl2 N5 O2
Formal charge:0
Formula weight:382.244 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs10.044-{[(2,6-dichlorophenyl)carbonyl]amino}-N-piperidin-4-yl-1H-pyrazole-3-carboxamide
OpenEye OEToolkits1.5.04-[(2,6-dichlorophenyl)carbonylamino]-N-piperidin-4-yl-1H-pyrazole-3-carboxamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(NC1CCNCC1)c3nncc3NC(=O)c2c(Cl)cccc2Cl
SMILES_CANONICALCACTVS3.341Clc1cccc(Cl)c1C(=O)Nc2c[nH]nc2C(=O)NC3CCNCC3
SMILESCACTVS3.341Clc1cccc(Cl)c1C(=O)Nc2c[nH]nc2C(=O)NC3CCNCC3
SMILES_CANONICALOpenEye OEToolkits1.5.0c1cc(c(c(c1)Cl)C(=O)Nc2c[nH]nc2C(=O)NC3CCNCC3)Cl
SMILESOpenEye OEToolkits1.5.0c1cc(c(c(c1)Cl)C(=O)Nc2c[nH]nc2C(=O)NC3CCNCC3)Cl
InChIInChI1.03InChI=1S/C16H17Cl2N5O2/c17-10-2-1-3-11(18)13(10)15(24)22-12-8-20-23-14(12)16(25)21-9-4-6-19-7-5-9/h1-3,8-9,19H,4-7H2,(H,20,23)(H,21,25)(H,22,24)
InChIKeyInChI1.03OVPNQJVDAFNBDN-UHFFFAOYSA-N

218500

PDB entries from 2024-04-17

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