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

Systemtic Name: 3-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-5-(furan-2-yl)-1,2,4-triazol-4-amine Openeye Name: 3-[(4,5-dimethoxy-2-methyl-phenyl)methylsulfanyl]-5-(2-furyl)-1,2,4-triazol-4-amine CAS Name: 3-[(4,5-dimethoxy-2-methylphenyl)methylthio]-5-(2-furanyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[(4,5-dimethoxy-2-methylphenyl)methylsulfanyl]-5-(furan-2-yl)-1,2,4-triazol-4-amine Traditional Name: [3-[(4,5-dimethoxy-2-methyl-benzyl)thio]-5-(2-furyl)-1,2,4-triazol-4-yl]amine Formula: C16H18N4O3S MolecularWeight: 346.40412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CSC2=NN=C(N2N)C3=CC=CO3)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1CSC2=NN=C(N2N)C3=CC=CO3)OC)OC

InChI

InChI=1S/C16H18N4O3S/c1-10-7-13(21-2)14(22-3)8-11(10)9-24-16-19-18-15(20(16)17)12-5-4-6-23-12/h4-8H,9,17H2,1-3H3