N-(3,4-dimethoxyphenyl)-3-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine

Systemtic Name: N-(3,4-dimethoxyphenyl)-3-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine Openeye Name: N-(3,4-dimethoxyphenyl)-3-(o-tolylmethylsulfanyl)-1H-1,2,4-triazol-5-amine CAS Name: N-(3,4-dimethoxyphenyl)-3-[(2-methylphenyl)methylthio]-1H-1,2,4-triazol-5-amine IUPAC Name: N-(3,4-dimethoxyphenyl)-3-[(2-methylphenyl)methylsulfanyl]-1H-1,2,4-triazol-5-amine Traditional Name: (3,4-dimethoxyphenyl)-[3-[(2-methylbenzyl)thio]-1H-1,2,4-triazol-5-yl]amine Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NNC(=N2)NC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=CC=C1CSC2=NNC(=N2)NC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C18H20N4O2S/c1-12-6-4-5-7-13(12)11-25-18-20-17(21-22-18)19-14-8-9-15(23-2)16(10-14)24-3/h4-10H,11H2,1-3H3,(H2,19,20,21,22)