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A1BD8

Summary
Name:(3s,5s,7s)-N'-(2-chlorophenyl)adamantane-1-carbohydrazide
Formula:C17 H21 Cl N2 O
Formal charge:0
Formula weight:304.814 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs14.52(3s,5s,7s)-N'-(2-chlorophenyl)adamantane-1-carbohydrazide
OpenEye OEToolkits3.1.0.0~{N}'-(2-chlorophenyl)adamantane-1-carbohydrazide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs14.52Clc1ccccc1NNC(=O)C12CC3CC(CC(C1)C3)C2
InChIInChI1.06InChI=1S/C17H21ClN2O/c18-14-3-1-2-4-15(14)19-20-16(21)17-8-11-5-12(9-17)7-13(6-11)10-17/h1-4,11-13,19H,5-10H2,(H,20,21)/t11-,12+,13-,17-
InChIKeyInChI1.06MRUZONZFWMDWAL-FBBPANFNSA-N
SMILES_CANONICALCACTVS3.385Clc1ccccc1NNC(=O)C23CC4CC(CC(C4)C2)C3
SMILESCACTVS3.385Clc1ccccc1NNC(=O)C23CC4CC(CC(C4)C2)C3
SMILES_CANONICALOpenEye OEToolkits3.1.0.0c1ccc(c(c1)NNC(=O)C23CC4CC(C2)CC(C4)C3)Cl
SMILESOpenEye OEToolkits3.1.0.0c1ccc(c(c1)NNC(=O)C23CC4CC(C2)CC(C4)C3)Cl

248335

PDB entries from 2026-01-28

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