5-(3-phenylsulfanylpropyl)-1,2-dihydro-1,2,4-triazole-3-thione

Systemtic Name: 5-(3-phenylsulfanylpropyl)-1,2-dihydro-1,2,4-triazole-3-thione Openeye Name: 5-(3-phenylsulfanylpropyl)-1,2-dihydro-1,2,4-triazole-3-thione CAS Name: 5-[3-(phenylthio)propyl]-1,2-dihydro-1,2,4-triazole-3-thione IUPAC Name: 5-(3-phenylsulfanylpropyl)-1,2-dihydro-1,2,4-triazole-3-thione Traditional Name: 5-[3-(phenylthio)propyl]-1,2-dihydro-1,2,4-triazole-3-thione Formula: C11H13N3S2 MolecularWeight: 251.37102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCC2=NC(=S)NN2

Isomeric SMILES

C1=CC=C(C=C1)SCCCC2=NC(=S)NN2

InChI

InChI=1S/C11H13N3S2/c15-11-12-10(13-14-11)7-4-8-16-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H2,12,13,14,15)