4-[(4-methylphenyl)methyl]-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-amine

Systemtic Name: 4-[(4-methylphenyl)methyl]-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-amine Openeye Name: 5-benzylsulfanyl-4-(p-tolylmethyl)-1,2,4-triazol-3-amine CAS Name: 4-[(4-methylphenyl)methyl]-5-(phenylmethylthio)-1,2,4-triazol-3-amine IUPAC Name: 5-benzylsulfanyl-4-[(4-methylphenyl)methyl]-1,2,4-triazol-3-amine Traditional Name: [5-(benzylthio)-4-(4-methylbenzyl)-1,2,4-triazol-3-yl]amine Formula: C17H18N4S MolecularWeight: 310.41662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=NN=C2SCC3=CC=CC=C3)N

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=NN=C2SCC3=CC=CC=C3)N

InChI

InChI=1S/C17H18N4S/c1-13-7-9-14(10-8-13)11-21-16(18)19-20-17(21)22-12-15-5-3-2-4-6-15/h2-10H,11-12H2,1H3,(H2,18,19)