3-(1H-indol-2-ylmethylsulfanyl)-N-phenyl-1H-1,2,4-triazol-5-amine

Systemtic Name: 3-(1H-indol-2-ylmethylsulfanyl)-N-phenyl-1H-1,2,4-triazol-5-amine Openeye Name: 3-(1H-indol-2-ylmethylsulfanyl)-N-phenyl-1H-1,2,4-triazol-5-amine CAS Name: 3-(1H-indol-2-ylmethylthio)-N-phenyl-1H-1,2,4-triazol-5-amine IUPAC Name: 3-(1H-indol-2-ylmethylsulfanyl)-N-phenyl-1H-1,2,4-triazol-5-amine Traditional Name: [3-(1H-indol-2-ylmethylthio)-1H-1,2,4-triazol-5-yl]-phenyl-amine Formula: C17H15N5S MolecularWeight: 321.3995

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NN2)SCC3=CC4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NN2)SCC3=CC4=CC=CC=C4N3

InChI

InChI=1S/C17H15N5S/c1-2-7-13(8-3-1)19-16-20-17(22-21-16)23-11-14-10-12-6-4-5-9-15(12)18-14/h1-10,18H,11H2,(H2,19,20,21,22)