N-[[2-(2,6-dimethylphenoxy)pyridin-3-yl]methyl]thian-4-amine

Systemtic Name: N-[[2-(2,6-dimethylphenoxy)pyridin-3-yl]methyl]thian-4-amine Openeye Name: N-[[2-(2,6-dimethylphenoxy)-3-pyridyl]methyl]tetrahydrothiopyran-4-amine CAS Name: N-[[2-(2,6-dimethylphenoxy)-3-pyridinyl]methyl]-4-thianamine IUPAC Name: N-[[2-(2,6-dimethylphenoxy)pyridin-3-yl]methyl]thian-4-amine Traditional Name: [2-(2,6-dimethylphenoxy)-3-pyridyl]methyl-tetrahydrothiopyran-4-yl-amine Formula: C19H24N2OS MolecularWeight: 328.47166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC2=C(C=CC=N2)CNC3CCSCC3

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC2=C(C=CC=N2)CNC3CCSCC3

InChI

InChI=1S/C19H24N2OS/c1-14-5-3-6-15(2)18(14)22-19-16(7-4-10-20-19)13-21-17-8-11-23-12-9-17/h3-7,10,17,21H,8-9,11-13H2,1-2H3