3-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazol-4-amine Openeye Name: 3-(1-naphthylmethylsulfanyl)-5-[3-(p-tolyl)-1H-pyrazol-5-yl]-1,2,4-triazol-4-amine CAS Name: 3-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-5-(1-naphthalenylmethylthio)-1,2,4-triazol-4-amine IUPAC Name: 3-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-5-(naphthalen-1-ylmethylsulfanyl)-1,2,4-triazol-4-amine Traditional Name: [3-(1-naphthylmethylthio)-5-[3-(p-tolyl)-1H-pyrazol-5-yl]-1,2,4-triazol-4-yl]amine Formula: C23H20N6S MolecularWeight: 412.5101

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=C2)C3=NN=C(N3N)SCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=C2)C3=NN=C(N3N)SCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C23H20N6S/c1-15-9-11-17(12-10-15)20-13-21(26-25-20)22-27-28-23(29(22)24)30-14-18-7-4-6-16-5-2-3-8-19(16)18/h2-13H,14,24H2,1H3,(H,25,26)