3-(quinolin-8-ylmethylsulfanyl)-1H-1,2,4-triazol-5-amine

Systemtic Name: 3-(quinolin-8-ylmethylsulfanyl)-1H-1,2,4-triazol-5-amine Openeye Name: 3-(8-quinolylmethylsulfanyl)-1H-1,2,4-triazol-5-amine CAS Name: 3-(8-quinolinylmethylthio)-1H-1,2,4-triazol-5-amine IUPAC Name: 3-(quinolin-8-ylmethylsulfanyl)-1H-1,2,4-triazol-5-amine Traditional Name: [3-(8-quinolylmethylthio)-1H-1,2,4-triazol-5-yl]amine Formula: C12H11N5S MolecularWeight: 257.31424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)CSC3=NNC(=N3)N)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)CSC3=NNC(=N3)N)N=CC=C2

InChI

InChI=1S/C12H11N5S/c13-11-15-12(17-16-11)18-7-9-4-1-3-8-5-2-6-14-10(8)9/h1-6H,7H2,(H3,13,15,16,17)