N,N-diethyl-1-[4-(3-pyridin-3-ylpropanoylamino)cyclohexyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N,N-diethyl-1-[4-(3-pyridin-3-ylpropanoylamino)cyclohexyl]-1,2,3-triazole-4-carboxamide Openeye Name: N,N-diethyl-1-[4-[3-(3-pyridyl)propanoylamino]cyclohexyl]triazole-4-carboxamide CAS Name: N,N-diethyl-1-[4-[[1-oxo-3-(3-pyridinyl)propyl]amino]cyclohexyl]-4-triazolecarboxamide IUPAC Name: N,N-diethyl-1-[4-(3-pyridin-3-ylpropanoylamino)cyclohexyl]triazole-4-carboxamide Traditional Name: N,N-diethyl-1-[4-[3-(3-pyridyl)propanoylamino]cyclohexyl]triazole-4-carboxamide Formula: C21H30N6O2 MolecularWeight: 398.5019

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CN(N=N1)C2CCC(CC2)NC(=O)CCC3=CN=CC=C3

Isomeric SMILES

CCN(CC)C(=O)C1=CN(N=N1)C2CCC(CC2)NC(=O)CCC3=CN=CC=C3

InChI

InChI=1S/C21H30N6O2/c1-3-26(4-2)21(29)19-15-27(25-24-19)18-10-8-17(9-11-18)23-20(28)12-7-16-6-5-13-22-14-16/h5-6,13-15,17-18H,3-4,7-12H2,1-2H3,(H,23,28)