5-(1H-indol-3-ylmethyl)-1,2,4-triazole-3,4-diamine

Systemtic Name: 5-(1H-indol-3-ylmethyl)-1,2,4-triazole-3,4-diamine Openeye Name: 5-(1H-indol-3-ylmethyl)-1,2,4-triazole-3,4-diamine CAS Name: 5-(1H-indol-3-ylmethyl)-1,2,4-triazole-3,4-diamine IUPAC Name: 5-(1H-indol-3-ylmethyl)-1,2,4-triazole-3,4-diamine Traditional Name: [3-amino-5-(1H-indol-3-ylmethyl)-1,2,4-triazol-4-yl]amine Formula: C11H12N6 MolecularWeight: 228.25318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC3=NN=C(N3N)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC3=NN=C(N3N)N

InChI

InChI=1S/C11H12N6/c12-11-16-15-10(17(11)13)5-7-6-14-9-4-2-1-3-8(7)9/h1-4,6,14H,5,13H2,(H2,12,16)