3-[(2-methylphenoxy)methyl]-5-(2-methylprop-2-enylsulfanyl)-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[(2-methylphenoxy)methyl]-5-(2-methylprop-2-enylsulfanyl)-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-(2-methylallylsulfanyl)-5-[(2-methylphenoxy)methyl]-1,2,4-triazole CAS Name: 3-[(2-methylphenoxy)methyl]-5-(2-methylprop-2-enylthio)-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(2-methylphenoxy)methyl]-5-(2-methylprop-2-enylsulfanyl)-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-(2-methylallylthio)-5-[(2-methylphenoxy)methyl]-1,2,4-triazole Formula: C17H21N3OS MolecularWeight: 315.43314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC2=NN=C(N2CC=C)SCC(=C)C

Isomeric SMILES

CC1=CC=CC=C1OCC2=NN=C(N2CC=C)SCC(=C)C

InChI

InChI=1S/C17H21N3OS/c1-5-10-20-16(18-19-17(20)22-12-13(2)3)11-21-15-9-7-6-8-14(15)4/h5-9H,1-2,10-12H2,3-4H3