1-phenethyl-N-(4-pyrazol-1-ylbutan-2-yl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-phenethyl-N-(4-pyrazol-1-ylbutan-2-yl)-1,2,3-triazole-4-carboxamide Openeye Name: N-(1-methyl-3-pyrazol-1-yl-propyl)-1-phenethyl-triazole-4-carboxamide CAS Name: 1-phenethyl-N-[4-(1-pyrazolyl)butan-2-yl]-4-triazolecarboxamide IUPAC Name: 1-phenethyl-N-(4-pyrazol-1-ylbutan-2-yl)triazole-4-carboxamide Traditional Name: N-(1-methyl-3-pyrazol-1-yl-propyl)-1-phenethyl-triazole-4-carboxamide Formula: C18H22N6O MolecularWeight: 338.40688

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN1C=CC=N1)NC(=O)C2=CN(N=N2)CCC3=CC=CC=C3

Isomeric SMILES

CC(CCN1C=CC=N1)NC(=O)C2=CN(N=N2)CCC3=CC=CC=C3

InChI

InChI=1S/C18H22N6O/c1-15(8-12-23-11-5-10-19-23)20-18(25)17-14-24(22-21-17)13-9-16-6-3-2-4-7-16/h2-7,10-11,14-15H,8-9,12-13H2,1H3,(H,20,25)