3-[[1-(4-methyl-1,2,4-triazol-3-yl)ethylamino]methyl]benzenecarbonitrile

Systemtic Name: 3-[[1-(4-methyl-1,2,4-triazol-3-yl)ethylamino]methyl]benzenecarbonitrile Openeye Name: 3-[[1-(4-methyl-1,2,4-triazol-3-yl)ethylamino]methyl]benzonitrile CAS Name: 3-[[1-(4-methyl-1,2,4-triazol-3-yl)ethylamino]methyl]benzonitrile IUPAC Name: 3-[[1-(4-methyl-1,2,4-triazol-3-yl)ethylamino]methyl]benzonitrile Traditional Name: 3-[[1-(4-methyl-1,2,4-triazol-3-yl)ethylamino]methyl]benzonitrile Formula: C13H15N5 MolecularWeight: 241.2917

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=CN1C)NCC2=CC=CC(=C2)C#N

Isomeric SMILES

CC(C1=NN=CN1C)NCC2=CC=CC(=C2)C#N

InChI

InChI=1S/C13H15N5/c1-10(13-17-16-9-18(13)2)15-8-12-5-3-4-11(6-12)7-14/h3-6,9-10,15H,8H2,1-2H3