5-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-2,1,3-benzoxadiazole

Systemtic Name: 5-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-2,1,3-benzoxadiazole Openeye Name: 5-[[4-allyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-2,1,3-benzoxadiazole CAS Name: 5-[[[4-prop-2-enyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]methyl]-2,1,3-benzoxadiazole IUPAC Name: 5-[(4-prop-2-enyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-2,1,3-benzoxadiazole Traditional Name: 5-[[[4-allyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]benzofurazan Formula: C17H14N6OS MolecularWeight: 350.39766

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC2=CC3=NON=C3C=C2)C4=CN=CC=C4

Isomeric SMILES

C=CCN1C(=NN=C1SCC2=CC3=NON=C3C=C2)C4=CN=CC=C4

InChI

InChI=1S/C17H14N6OS/c1-2-8-23-16(13-4-3-7-18-10-13)19-20-17(23)25-11-12-5-6-14-15(9-12)22-24-21-14/h2-7,9-10H,1,8,11H2