3-azanyl-5-(1,2,4-triazol-1-ylmethyl)benzenethiol

Systemtic Name: 3-azanyl-5-(1,2,4-triazol-1-ylmethyl)benzenethiol Openeye Name: 3-amino-5-(1,2,4-triazol-1-ylmethyl)benzenethiol CAS Name: 3-amino-5-(1,2,4-triazol-1-ylmethyl)benzenethiol IUPAC Name: 3-amino-5-(1,2,4-triazol-1-ylmethyl)benzenethiol Traditional Name: 3-amino-5-(1,2,4-triazol-1-ylmethyl)benzenethiol Formula: C9H10N4S MolecularWeight: 206.2675

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1N)S)CN2C=NC=N2

Isomeric SMILES

C1=C(C=C(C=C1N)S)CN2C=NC=N2

InChI

InChI=1S/C9H10N4S/c10-8-1-7(2-9(14)3-8)4-13-6-11-5-12-13/h1-3,5-6,14H,4,10H2