4-(3-methoxyphenyl)-3-[2-(3-methyl-4-propan-2-yl-phenoxy)ethylsulfanyl]-1,2,4-triazole

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCSC2=NN=CN2C3=CC(=CC=C3)OC)C(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)OCCSC2=NN=CN2C3=CC(=CC=C3)OC)C(C)C

InChI

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