N-pentyl-4-(1,2,4-triazol-1-ylmethyl)aniline

Systemtic Name: N-pentyl-4-(1,2,4-triazol-1-ylmethyl)aniline Openeye Name: N-pentyl-4-(1,2,4-triazol-1-ylmethyl)aniline CAS Name: N-pentyl-4-(1,2,4-triazol-1-ylmethyl)aniline IUPAC Name: N-pentyl-4-(1,2,4-triazol-1-ylmethyl)aniline Traditional Name: amyl-[4-(1,2,4-triazol-1-ylmethyl)phenyl]amine Formula: C14H20N4 MolecularWeight: 244.3354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC1=CC=C(C=C1)CN2C=NC=N2

Isomeric SMILES

CCCCCNC1=CC=C(C=C1)CN2C=NC=N2

InChI

InChI=1S/C14H20N4/c1-2-3-4-9-16-14-7-5-13(6-8-14)10-18-12-15-11-17-18/h5-8,11-12,16H,2-4,9-10H2,1H3