3-[(5-azanyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propane-1-thiol

Systemtic Name: 3-[(5-azanyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propane-1-thiol Openeye Name: 3-[(5-amino-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propane-1-thiol CAS Name: 3-[(5-amino-1-phenyl-1,2,4-triazol-3-yl)thio]-1-propanethiol IUPAC Name: 3-[(5-amino-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propane-1-thiol Traditional Name: 3-[(5-amino-1-phenyl-1,2,4-triazol-3-yl)thio]propane-1-thiol Formula: C11H14N4S2 MolecularWeight: 266.38566

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NC(=N2)SCCCS)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NC(=N2)SCCCS)N

InChI

InChI=1S/C11H14N4S2/c12-10-13-11(17-8-4-7-16)14-15(10)9-5-2-1-3-6-9/h1-3,5-6,16H,4,7-8H2,(H2,12,13,14)