5-azanyl-1-(3-chlorophenyl)-N-(2-ethyl-6-methyl-phenyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-azanyl-1-(3-chlorophenyl)-N-(2-ethyl-6-methyl-phenyl)-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-(3-chlorophenyl)-N-(2-ethyl-6-methyl-phenyl)triazole-4-carboxamide CAS Name: 5-amino-1-(3-chlorophenyl)-N-(2-ethyl-6-methylphenyl)-4-triazolecarboxamide IUPAC Name: 5-amino-1-(3-chlorophenyl)-N-(2-ethyl-6-methylphenyl)triazole-4-carboxamide Traditional Name: 5-amino-1-(3-chlorophenyl)-N-(2-ethyl-6-methyl-phenyl)triazole-4-carboxamide Formula: C18H18ClN5O MolecularWeight: 355.82142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2=C(N(N=N2)C3=CC(=CC=C3)Cl)N)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C2=C(N(N=N2)C3=CC(=CC=C3)Cl)N)C

InChI

InChI=1S/C18H18ClN5O/c1-3-12-7-4-6-11(2)15(12)21-18(25)16-17(20)24(23-22-16)14-9-5-8-13(19)10-14/h4-10H,3,20H2,1-2H3,(H,21,25)