5-azanyl-1-(3,5-dimethylphenyl)-N-phenethyl-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-azanyl-1-(3,5-dimethylphenyl)-N-phenethyl-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-(3,5-dimethylphenyl)-N-phenethyl-triazole-4-carboxamide CAS Name: 5-amino-1-(3,5-dimethylphenyl)-N-phenethyl-4-triazolecarboxamide IUPAC Name: 5-amino-1-(3,5-dimethylphenyl)-N-phenethyltriazole-4-carboxamide Traditional Name: 5-amino-1-(3,5-dimethylphenyl)-N-phenethyl-triazole-4-carboxamide Formula: C19H21N5O MolecularWeight: 335.40294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=C(N=N2)C(=O)NCCC3=CC=CC=C3)N)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=C(N=N2)C(=O)NCCC3=CC=CC=C3)N)C

InChI

InChI=1S/C19H21N5O/c1-13-10-14(2)12-16(11-13)24-18(20)17(22-23-24)19(25)21-9-8-15-6-4-3-5-7-15/h3-7,10-12H,8-9,20H2,1-2H3,(H,21,25)