5-phenyl-3-prop-2-ynylsulfanyl-1H-1,2,4-triazole

Systemtic Name: 5-phenyl-3-prop-2-ynylsulfanyl-1H-1,2,4-triazole Openeye Name: 5-phenyl-3-prop-2-ynylsulfanyl-1H-1,2,4-triazole CAS Name: 5-phenyl-3-(prop-2-ynylthio)-1H-1,2,4-triazole IUPAC Name: 5-phenyl-3-prop-2-ynylsulfanyl-1H-1,2,4-triazole Traditional Name: 5-phenyl-3-(propargylthio)-1H-1,2,4-triazole Formula: C11H9N3S MolecularWeight: 215.27426

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Descriptors Computed from Structure

Canonical SMILES:

C#CCSC1=NNC(=N1)C2=CC=CC=C2

Isomeric SMILES

C#CCSC1=NNC(=N1)C2=CC=CC=C2

InChI

InChI=1S/C11H9N3S/c1-2-8-15-11-12-10(13-14-11)9-6-4-3-5-7-9/h1,3-7H,8H2,(H,12,13,14)