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

Systemtic Name: 3-[(3,5-dimethylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Openeye Name: 4-allyl-3-[(3,5-dimethylphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-[(3,5-dimethylphenyl)methylthio]-4-prop-2-enyl-1,2,4-triazole IUPAC Name: 3-[(3,5-dimethylphenyl)methylsulfanyl]-4-prop-2-enyl-1,2,4-triazole Traditional Name: 4-allyl-3-[(3,5-dimethylbenzyl)thio]-1,2,4-triazole Formula: C14H17N3S MolecularWeight: 259.36988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CSC2=NN=CN2CC=C)C

Isomeric SMILES

CC1=CC(=CC(=C1)CSC2=NN=CN2CC=C)C

InChI

InChI=1S/C14H17N3S/c1-4-5-17-10-15-16-14(17)18-9-13-7-11(2)6-12(3)8-13/h4,6-8,10H,1,5,9H2,2-3H3