N-butyl-5-chloranyl-2-(1,2,4-triazol-1-yl)aniline

Systemtic Name: N-butyl-5-chloranyl-2-(1,2,4-triazol-1-yl)aniline Openeye Name: N-butyl-5-chloro-2-(1,2,4-triazol-1-yl)aniline CAS Name: N-butyl-5-chloro-2-(1,2,4-triazol-1-yl)aniline IUPAC Name: N-butyl-5-chloro-2-(1,2,4-triazol-1-yl)aniline Traditional Name: butyl-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]amine Formula: C12H15ClN4 MolecularWeight: 250.7273

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=CC(=C1)Cl)N2C=NC=N2

Isomeric SMILES

CCCCNC1=C(C=CC(=C1)Cl)N2C=NC=N2

InChI

InChI=1S/C12H15ClN4/c1-2-3-6-15-11-7-10(13)4-5-12(11)17-9-14-8-16-17/h4-5,7-9,15H,2-3,6H2,1H3