3-(4-tert-butylphenyl)-4-methyl-5-prop-2-enylsulfanyl-1,2,4-triazole

Systemtic Name: 3-(4-tert-butylphenyl)-4-methyl-5-prop-2-enylsulfanyl-1,2,4-triazole Openeye Name: 3-allylsulfanyl-5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazole CAS Name: 3-(4-tert-butylphenyl)-4-methyl-5-(prop-2-enylthio)-1,2,4-triazole IUPAC Name: 3-(4-tert-butylphenyl)-4-methyl-5-prop-2-enylsulfanyl-1,2,4-triazole Traditional Name: 3-(allylthio)-5-(4-tert-butylphenyl)-4-methyl-1,2,4-triazole Formula: C16H21N3S MolecularWeight: 287.42304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCC=C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCC=C

InChI

InChI=1S/C16H21N3S/c1-6-11-20-15-18-17-14(19(15)5)12-7-9-13(10-8-12)16(2,3)4/h6-10H,1,11H2,2-5H3