3-(7-methoxy-1-benzofuran-2-yl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(7-methoxy-1-benzofuran-2-yl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-allyl-3-(7-methoxybenzofuran-2-yl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(7-methoxy-2-benzofuranyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(7-methoxy-1-benzofuran-2-yl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-allyl-3-(7-methoxybenzofuran-2-yl)-1H-1,2,4-triazole-5-thione Formula: C14H13N3O2S MolecularWeight: 287.33692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=C2)C3=NNC(=S)N3CC=C

Isomeric SMILES

COC1=CC=CC2=C1OC(=C2)C3=NNC(=S)N3CC=C

InChI

InChI=1S/C14H13N3O2S/c1-3-7-17-13(15-16-14(17)20)11-8-9-5-4-6-10(18-2)12(9)19-11/h3-6,8H,1,7H2,2H3,(H,16,20)