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

Systemtic Name: N,N-diethyl-1-[4-(2-phenoxyethanoylamino)cyclohexyl]-1,2,3-triazole-4-carboxamide Openeye Name: N,N-diethyl-1-[4-[(2-phenoxyacetyl)amino]cyclohexyl]triazole-4-carboxamide CAS Name: N,N-diethyl-1-[4-[(1-oxo-2-phenoxyethyl)amino]cyclohexyl]-4-triazolecarboxamide IUPAC Name: N,N-diethyl-1-[4-[(2-phenoxyacetyl)amino]cyclohexyl]triazole-4-carboxamide Traditional Name: N,N-diethyl-1-[4-[(2-phenoxyacetyl)amino]cyclohexyl]triazole-4-carboxamide Formula: C21H29N5O3 MolecularWeight: 399.48666

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CN(N=N1)C2CCC(CC2)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CCN(CC)C(=O)C1=CN(N=N1)C2CCC(CC2)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C21H29N5O3/c1-3-25(4-2)21(28)19-14-26(24-23-19)17-12-10-16(11-13-17)22-20(27)15-29-18-8-6-5-7-9-18/h5-9,14,16-17H,3-4,10-13,15H2,1-2H3,(H,22,27)