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

Systemtic Name: 4-chloranyl-N-[(3-pyridin-3-yl-1H-1,2,4-triazol-5-yl)methyl]aniline Openeye Name: 4-chloro-N-[[3-(3-pyridyl)-1H-1,2,4-triazol-5-yl]methyl]aniline CAS Name: 4-chloro-N-[[3-(3-pyridinyl)-1H-1,2,4-triazol-5-yl]methyl]aniline IUPAC Name: 4-chloro-N-[(3-pyridin-3-yl-1H-1,2,4-triazol-5-yl)methyl]aniline Traditional Name: (4-chlorophenyl)-[[3-(3-pyridyl)-1H-1,2,4-triazol-5-yl]methyl]amine Formula: C14H12ClN5 MolecularWeight: 285.73158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NNC(=N2)CNC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CN=C1)C2=NNC(=N2)CNC3=CC=C(C=C3)Cl

InChI

InChI=1S/C14H12ClN5/c15-11-3-5-12(6-4-11)17-9-13-18-14(20-19-13)10-2-1-7-16-8-10/h1-8,17H,9H2,(H,18,19,20)