3-[(2-ethoxy-4-methyl-phenoxy)methyl]-5-(2-phenoxyethylsulfanyl)-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[(2-ethoxy-4-methyl-phenoxy)methyl]-5-(2-phenoxyethylsulfanyl)-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(2-ethoxy-4-methyl-phenoxy)methyl]-5-(2-phenoxyethylsulfanyl)-1,2,4-triazole CAS Name: 3-[(2-ethoxy-4-methylphenoxy)methyl]-5-(2-phenoxyethylthio)-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(2-ethoxy-4-methylphenoxy)methyl]-5-(2-phenoxyethylsulfanyl)-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(2-ethoxy-4-methyl-phenoxy)methyl]-5-(2-phenoxyethylthio)-1,2,4-triazole Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C)OCC2=NN=C(N2CC=C)SCCOC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C)OCC2=NN=C(N2CC=C)SCCOC3=CC=CC=C3

InChI

InChI=1S/C23H27N3O3S/c1-4-13-26-22(17-29-20-12-11-18(3)16-21(20)27-5-2)24-25-23(26)30-15-14-28-19-9-7-6-8-10-19/h4,6-12,16H,1,5,13-15,17H2,2-3H3