3-(4-methoxyphenyl)-5-[2-(2-methylphenoxy)ethylsulfanyl]-4-propan-2-yl-1,2,4-triazole

Systemtic Name: 3-(4-methoxyphenyl)-5-[2-(2-methylphenoxy)ethylsulfanyl]-4-propan-2-yl-1,2,4-triazole Openeye Name: 4-isopropyl-3-(4-methoxyphenyl)-5-[2-(2-methylphenoxy)ethylsulfanyl]-1,2,4-triazole CAS Name: 3-(4-methoxyphenyl)-5-[2-(2-methylphenoxy)ethylthio]-4-propan-2-yl-1,2,4-triazole IUPAC Name: 3-(4-methoxyphenyl)-5-[2-(2-methylphenoxy)ethylsulfanyl]-4-propan-2-yl-1,2,4-triazole Traditional Name: 4-isopropyl-3-(4-methoxyphenyl)-5-[2-(2-methylphenoxy)ethylthio]-1,2,4-triazole Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCSC2=NN=C(N2C(C)C)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=CC=C1OCCSC2=NN=C(N2C(C)C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H25N3O2S/c1-15(2)24-20(17-9-11-18(25-4)12-10-17)22-23-21(24)27-14-13-26-19-8-6-5-7-16(19)3/h5-12,15H,13-14H2,1-4H3