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

Systemtic Name: 3-[(4-methylphenyl)methylsulfanyl]-5-[(4-propan-2-ylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(4-isopropylphenoxy)methyl]-5-(p-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-[(4-methylphenyl)methylthio]-5-[(4-propan-2-ylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(4-methylphenyl)methylsulfanyl]-5-[(4-propan-2-ylphenoxy)methyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(4-isopropylphenoxy)methyl]-5-[(4-methylbenzyl)thio]-1,2,4-triazole Formula: C23H27N3OS MolecularWeight: 393.54498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3OS/c1-5-14-26-22(15-27-21-12-10-20(11-13-21)17(2)3)24-25-23(26)28-16-19-8-6-18(4)7-9-19/h5-13,17H,1,14-16H2,2-4H3