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

Systemtic Name: 3-cyclohexyl-5-[(3-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-cyclohexyl-5-(m-tolylmethylsulfanyl)-1,2,4-triazole CAS Name: 3-cyclohexyl-5-[(3-methylphenyl)methylthio]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-cyclohexyl-5-[(3-methylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-cyclohexyl-5-[(3-methylbenzyl)thio]-1,2,4-triazole Formula: C19H25N3S MolecularWeight: 327.4869

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NN=C(N2CC=C)C3CCCCC3

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NN=C(N2CC=C)C3CCCCC3

InChI

InChI=1S/C19H25N3S/c1-3-12-22-18(17-10-5-4-6-11-17)20-21-19(22)23-14-16-9-7-8-15(2)13-16/h3,7-9,13,17H,1,4-6,10-12,14H2,2H3