4-(4-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)butan-1-amine

Systemtic Name: 4-(4-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)butan-1-amine Openeye Name: 4-(4-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)butan-1-amine CAS Name: 4-(4-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)-1-butanamine IUPAC Name: 4-(4-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)butan-1-amine Traditional Name: [4-(4-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)butyl]amine Formula: C13H17ClN4 MolecularWeight: 264.75388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC(CN)CN2C=NC=N2)Cl

Isomeric SMILES

C1=CC(=CC=C1CCC(CN)CN2C=NC=N2)Cl

InChI

InChI=1S/C13H17ClN4/c14-13-5-3-11(4-6-13)1-2-12(7-15)8-18-10-16-9-17-18/h3-6,9-10,12H,1-2,7-8,15H2