3-(3,4-dimethoxyphenyl)-4-(3-methoxypropyl)-5-[2-(3-methylphenoxy)ethylsulfanyl]-1,2,4-triazole

Systemtic Name: 3-(3,4-dimethoxyphenyl)-4-(3-methoxypropyl)-5-[2-(3-methylphenoxy)ethylsulfanyl]-1,2,4-triazole Openeye Name: 3-(3,4-dimethoxyphenyl)-4-(3-methoxypropyl)-5-[2-(3-methylphenoxy)ethylsulfanyl]-1,2,4-triazole CAS Name: 3-(3,4-dimethoxyphenyl)-4-(3-methoxypropyl)-5-[2-(3-methylphenoxy)ethylthio]-1,2,4-triazole IUPAC Name: 3-(3,4-dimethoxyphenyl)-4-(3-methoxypropyl)-5-[2-(3-methylphenoxy)ethylsulfanyl]-1,2,4-triazole Traditional Name: 3-(3,4-dimethoxyphenyl)-4-(3-methoxypropyl)-5-[2-(3-methylphenoxy)ethylthio]-1,2,4-triazole Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCSC2=NN=C(N2CCCOC)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC(=CC=C1)OCCSC2=NN=C(N2CCCOC)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C23H29N3O4S/c1-17-7-5-8-19(15-17)30-13-14-31-23-25-24-22(26(23)11-6-12-27-2)18-9-10-20(28-3)21(16-18)29-4/h5,7-10,15-16H,6,11-14H2,1-4H3