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

Systemtic Name: 3-(2-methylphenyl)-5-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2,4-oxadiazole Openeye Name: 5-[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-3-(o-tolyl)-1,2,4-oxadiazole CAS Name: 3-(2-methylphenyl)-5-[[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(2-methylphenyl)-5-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2,4-oxadiazole Traditional Name: 5-[[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]-3-(o-tolyl)-1,2,4-oxadiazole Formula: C20H18N6OS MolecularWeight: 390.46152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NOC(=N2)CSC3=NN=C(N3CC=C)C4=CC=NC=C4

Isomeric SMILES

CC1=CC=CC=C1C2=NOC(=N2)CSC3=NN=C(N3CC=C)C4=CC=NC=C4

InChI

InChI=1S/C20H18N6OS/c1-3-12-26-19(15-8-10-21-11-9-15)23-24-20(26)28-13-17-22-18(25-27-17)16-7-5-4-6-14(16)2/h3-11H,1,12-13H2,2H3