3-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-4-amine Openeye Name: 3-[(2-methoxy-5-methyl-phenyl)methylsulfanyl]-5-(1-naphthylmethyl)-1,2,4-triazol-4-amine CAS Name: 3-[(2-methoxy-5-methylphenyl)methylthio]-5-(1-naphthalenylmethyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[(2-methoxy-5-methylphenyl)methylsulfanyl]-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-4-amine Traditional Name: [3-[(2-methoxy-5-methyl-benzyl)thio]-5-(1-naphthylmethyl)-1,2,4-triazol-4-yl]amine Formula: C22H22N4OS MolecularWeight: 390.50128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CSC2=NN=C(N2N)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CSC2=NN=C(N2N)CC3=CC=CC4=CC=CC=C43

InChI

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