1-[(2-chlorophenyl)methyl]-N-methyl-N-(1-pyrimidin-4-ylethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-[(2-chlorophenyl)methyl]-N-methyl-N-(1-pyrimidin-4-ylethyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-[(2-chlorophenyl)methyl]-N-methyl-N-(1-pyrimidin-4-ylethyl)triazole-4-carboxamide CAS Name: 1-[(2-chlorophenyl)methyl]-N-methyl-N-[1-(4-pyrimidinyl)ethyl]-4-triazolecarboxamide IUPAC Name: 1-[(2-chlorophenyl)methyl]-N-methyl-N-(1-pyrimidin-4-ylethyl)triazole-4-carboxamide Traditional Name: 1-(2-chlorobenzyl)-N-methyl-N-[1-(4-pyrimidyl)ethyl]triazole-4-carboxamide Formula: C17H17ClN6O MolecularWeight: 356.80948

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC=NC=C1)N(C)C(=O)C2=CN(N=N2)CC3=CC=CC=C3Cl

Isomeric SMILES

CC(C1=NC=NC=C1)N(C)C(=O)C2=CN(N=N2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C17H17ClN6O/c1-12(15-7-8-19-11-20-15)23(2)17(25)16-10-24(22-21-16)9-13-5-3-4-6-14(13)18/h3-8,10-12H,9H2,1-2H3