3-(4-ethoxyphenyl)-5-[3-(3-methylphenoxy)propylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-(4-ethoxyphenyl)-5-[3-(3-methylphenoxy)propylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-(4-ethoxyphenyl)-5-[3-(3-methylphenoxy)propylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-(4-ethoxyphenyl)-5-[3-(3-methylphenoxy)propylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(4-ethoxyphenyl)-5-[3-(3-methylphenoxy)propylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-[3-(3-methylphenoxy)propylthio]-5-p-phenetyl-1,2,4-triazol-4-yl]amine Formula: C20H24N4O2S MolecularWeight: 384.49516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN=C(N2N)SCCCOC3=CC=CC(=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN=C(N2N)SCCCOC3=CC=CC(=C3)C

InChI

InChI=1S/C20H24N4O2S/c1-3-25-17-10-8-16(9-11-17)19-22-23-20(24(19)21)27-13-5-12-26-18-7-4-6-15(2)14-18/h4,6-11,14H,3,5,12-13,21H2,1-2H3