3-[2-(2-methoxyphenoxy)ethylsulfanyl]-5-(2-methylphenyl)-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[2-(2-methoxyphenoxy)ethylsulfanyl]-5-(2-methylphenyl)-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[2-(2-methoxyphenoxy)ethylsulfanyl]-5-(o-tolyl)-1,2,4-triazole CAS Name: 3-[2-(2-methoxyphenoxy)ethylthio]-5-(2-methylphenyl)-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[2-(2-methoxyphenoxy)ethylsulfanyl]-5-(2-methylphenyl)-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[2-(2-methoxyphenoxy)ethylthio]-5-(o-tolyl)-1,2,4-triazole Formula: C21H23N3O2S MolecularWeight: 381.49122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(N2CC=C)SCCOC3=CC=CC=C3OC

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(N2CC=C)SCCOC3=CC=CC=C3OC

InChI

InChI=1S/C21H23N3O2S/c1-4-13-24-20(17-10-6-5-9-16(17)2)22-23-21(24)27-15-14-26-19-12-8-7-11-18(19)25-3/h4-12H,1,13-15H2,2-3H3