4-ethyl-3-[3-(4-ethylphenoxy)propylsulfanyl]-5-[(4-methylphenyl)sulfonylmethyl]-1,2,4-triazole

Systemtic Name: 4-ethyl-3-[3-(4-ethylphenoxy)propylsulfanyl]-5-[(4-methylphenyl)sulfonylmethyl]-1,2,4-triazole Openeye Name: 4-ethyl-3-[3-(4-ethylphenoxy)propylsulfanyl]-5-(p-tolylsulfonylmethyl)-1,2,4-triazole CAS Name: 4-ethyl-3-[3-(4-ethylphenoxy)propylthio]-5-[(4-methylphenyl)sulfonylmethyl]-1,2,4-triazole IUPAC Name: 4-ethyl-3-[3-(4-ethylphenoxy)propylsulfanyl]-5-[(4-methylphenyl)sulfonylmethyl]-1,2,4-triazole Traditional Name: 4-ethyl-3-[3-(4-ethylphenoxy)propylthio]-5-(tosylmethyl)-1,2,4-triazole Formula: C23H29N3O3S2 MolecularWeight: 459.62466

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCCCSC2=NN=C(N2CC)CS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC1=CC=C(C=C1)OCCCSC2=NN=C(N2CC)CS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H29N3O3S2/c1-4-19-9-11-20(12-10-19)29-15-6-16-30-23-25-24-22(26(23)5-2)17-31(27,28)21-13-7-18(3)8-14-21/h7-14H,4-6,15-17H2,1-3H3