2-[(5-phenylazanyl-1H-1,2,4-triazol-3-yl)amino]ethanethiol

Systemtic Name: 2-[(5-phenylazanyl-1H-1,2,4-triazol-3-yl)amino]ethanethiol Openeye Name: 2-[(5-anilino-1H-1,2,4-triazol-3-yl)amino]ethanethiol CAS Name: 2-[(5-anilino-1H-1,2,4-triazol-3-yl)amino]ethanethiol IUPAC Name: 2-[(5-anilino-1H-1,2,4-triazol-3-yl)amino]ethanethiol Traditional Name: 2-[(5-anilino-1H-1,2,4-triazol-3-yl)amino]ethanethiol Formula: C10H13N5S MolecularWeight: 235.30872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NN2)NCCS

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NN2)NCCS

InChI

InChI=1S/C10H13N5S/c16-7-6-11-9-13-10(15-14-9)12-8-4-2-1-3-5-8/h1-5,16H,6-7H2,(H3,11,12,13,14,15)