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

Systemtic Name: 3-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-4-amine Openeye Name: 3-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-5-(1-naphthylmethyl)-1,2,4-triazol-4-amine CAS Name: 3-[(4,5-dimethoxy-2-methylphenyl)methylthio]-5-(1-naphthalenylmethyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[(4,5-dimethoxy-2-methylphenyl)methylsulfanyl]-5-(naphthalen-1-ylmethyl)-1,2,4-triazol-4-amine Traditional Name: [3-[(4,5-dimethoxy-2-methyl-benzyl)thio]-5-(1-naphthylmethyl)-1,2,4-triazol-4-yl]amine Formula: C23H24N4O2S MolecularWeight: 420.52726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CSC2=NN=C(N2N)CC3=CC=CC4=CC=CC=C43)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CSC2=NN=C(N2N)CC3=CC=CC4=CC=CC=C43)OC)OC

InChI

InChI=1S/C23H24N4O2S/c1-15-11-20(28-2)21(29-3)12-18(15)14-30-23-26-25-22(27(23)24)13-17-9-6-8-16-7-4-5-10-19(16)17/h4-12H,13-14,24H2,1-3H3