3-[(4-methylphenyl)methylsulfanyl]-5-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-4-prop-2-enyl-1,2,4-triazole

Systemtic Name: 3-[(4-methylphenyl)methylsulfanyl]-5-[(5-methyl-2-propan-2-yl-phenoxy)methyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(2-isopropyl-5-methyl-phenoxy)methyl]-5-(p-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-[(4-methylphenyl)methylthio]-5-[(5-methyl-2-propan-2-ylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(4-methylphenyl)methylsulfanyl]-5-[(5-methyl-2-propan-2-ylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(2-isopropyl-5-methyl-phenoxy)methyl]-5-[(4-methylbenzyl)thio]-1,2,4-triazole Formula: C24H29N3OS MolecularWeight: 407.57156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(N2CC=C)COC3=C(C=CC(=C3)C)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(N2CC=C)COC3=C(C=CC(=C3)C)C(C)C

InChI

InChI=1S/C24H29N3OS/c1-6-13-27-23(15-28-22-14-19(5)9-12-21(22)17(2)3)25-26-24(27)29-16-20-10-7-18(4)8-11-20/h6-12,14,17H,1,13,15-16H2,2-5H3