N-butan-2-yl-4-(1,2,4-triazol-1-ylmethyl)aniline

Systemtic Name: N-butan-2-yl-4-(1,2,4-triazol-1-ylmethyl)aniline Openeye Name: N-sec-butyl-4-(1,2,4-triazol-1-ylmethyl)aniline CAS Name: N-butan-2-yl-4-(1,2,4-triazol-1-ylmethyl)aniline IUPAC Name: N-butan-2-yl-4-(1,2,4-triazol-1-ylmethyl)aniline Traditional Name: sec-butyl-[4-(1,2,4-triazol-1-ylmethyl)phenyl]amine Formula: C13H18N4 MolecularWeight: 230.30882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1=CC=C(C=C1)CN2C=NC=N2

Isomeric SMILES

CCC(C)NC1=CC=C(C=C1)CN2C=NC=N2

InChI

InChI=1S/C13H18N4/c1-3-11(2)16-13-6-4-12(5-7-13)8-17-10-14-9-15-17/h4-7,9-11,16H,3,8H2,1-2H3