3-(naphthalen-1-ylmethylsulfanyl)-5-(3-propan-2-yloxyphenyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-(naphthalen-1-ylmethylsulfanyl)-5-(3-propan-2-yloxyphenyl)-1,2,4-triazol-4-amine Openeye Name: 3-(3-isopropoxyphenyl)-5-(1-naphthylmethylsulfanyl)-1,2,4-triazol-4-amine CAS Name: 3-(1-naphthalenylmethylthio)-5-(3-propan-2-yloxyphenyl)-1,2,4-triazol-4-amine IUPAC Name: 3-(naphthalen-1-ylmethylsulfanyl)-5-(3-propan-2-yloxyphenyl)-1,2,4-triazol-4-amine Traditional Name: [3-(3-isopropoxyphenyl)-5-(1-naphthylmethylthio)-1,2,4-triazol-4-yl]amine Formula: C22H22N4OS MolecularWeight: 390.50128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C2=NN=C(N2N)SCC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C2=NN=C(N2N)SCC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H22N4OS/c1-15(2)27-19-11-6-9-17(13-19)21-24-25-22(26(21)23)28-14-18-10-5-8-16-7-3-4-12-20(16)18/h3-13,15H,14,23H2,1-2H3