4-[(3-butyl-5-pyridin-4-yl-1,2,4-triazol-4-yl)methyl]aniline

Systemtic Name: 4-[(3-butyl-5-pyridin-4-yl-1,2,4-triazol-4-yl)methyl]aniline Openeye Name: 4-[[3-butyl-5-(4-pyridyl)-1,2,4-triazol-4-yl]methyl]aniline CAS Name: 4-[(3-butyl-5-pyridin-4-yl-1,2,4-triazol-4-yl)methyl]aniline IUPAC Name: 4-[(3-butyl-5-pyridin-4-yl-1,2,4-triazol-4-yl)methyl]aniline Traditional Name: [4-[[3-butyl-5-(4-pyridyl)-1,2,4-triazol-4-yl]methyl]phenyl]amine Formula: C18H21N5 MolecularWeight: 307.39284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(N1CC2=CC=C(C=C2)N)C3=CC=NC=C3

Isomeric SMILES

CCCCC1=NN=C(N1CC2=CC=C(C=C2)N)C3=CC=NC=C3

InChI

InChI=1S/C18H21N5/c1-2-3-4-17-21-22-18(15-9-11-20-12-10-15)23(17)13-14-5-7-16(19)8-6-14/h5-12H,2-4,13,19H2,1H3