2-[4-[(4-methylphenyl)methyl]-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl]ethanamine

Systemtic Name: 2-[4-[(4-methylphenyl)methyl]-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl]ethanamine Openeye Name: 2-[5-allylsulfanyl-4-(p-tolylmethyl)-1,2,4-triazol-3-yl]ethanamine CAS Name: 2-[4-[(4-methylphenyl)methyl]-5-(prop-2-enylthio)-1,2,4-triazol-3-yl]ethanamine IUPAC Name: 2-[4-[(4-methylphenyl)methyl]-5-prop-2-enylsulfanyl-1,2,4-triazol-3-yl]ethanamine Traditional Name: 2-[5-(allylthio)-4-(4-methylbenzyl)-1,2,4-triazol-3-yl]ethylamine Formula: C15H20N4S MolecularWeight: 288.4111

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=NN=C2SCC=C)CCN

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=NN=C2SCC=C)CCN

InChI

InChI=1S/C15H20N4S/c1-3-10-20-15-18-17-14(8-9-16)19(15)11-13-6-4-12(2)5-7-13/h3-7H,1,8-11,16H2,2H3