N,N-dimethyl-1-[2-(4-methylsulfanylphenoxy)-5-(1,2,4-triazol-1-yl)phenyl]methanamine

Systemtic Name: N,N-dimethyl-1-[2-(4-methylsulfanylphenoxy)-5-(1,2,4-triazol-1-yl)phenyl]methanamine Openeye Name: N,N-dimethyl-1-[2-(4-methylsulfanylphenoxy)-5-(1,2,4-triazol-1-yl)phenyl]methanamine CAS Name: N,N-dimethyl-1-[2-[4-(methylthio)phenoxy]-5-(1,2,4-triazol-1-yl)phenyl]methanamine IUPAC Name: N,N-dimethyl-1-[2-(4-methylsulfanylphenoxy)-5-(1,2,4-triazol-1-yl)phenyl]methanamine Traditional Name: dimethyl-[2-[4-(methylthio)phenoxy]-5-(1,2,4-triazol-1-yl)benzyl]amine Formula: C18H20N4OS MolecularWeight: 340.4426

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=C(C=CC(=C1)N2C=NC=N2)OC3=CC=C(C=C3)SC

Isomeric SMILES

CN(C)CC1=C(C=CC(=C1)N2C=NC=N2)OC3=CC=C(C=C3)SC

InChI

InChI=1S/C18H20N4OS/c1-21(2)11-14-10-15(22-13-19-12-20-22)4-9-18(14)23-16-5-7-17(24-3)8-6-16/h4-10,12-13H,11H2,1-3H3