2-(2-tert-butyl-4-methyl-phenoxy)pyridine-3-carbothioamide

Systemtic Name: 2-(2-tert-butyl-4-methyl-phenoxy)pyridine-3-carbothioamide Openeye Name: 2-(2-tert-butyl-4-methyl-phenoxy)pyridine-3-carbothioamide CAS Name: 2-(2-tert-butyl-4-methylphenoxy)-3-pyridinecarbothioamide IUPAC Name: 2-(2-tert-butyl-4-methylphenoxy)pyridine-3-carbothioamide Traditional Name: 2-(2-tert-butyl-4-methyl-phenoxy)thionicotinamide Formula: C17H20N2OS MolecularWeight: 300.4185

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC2=C(C=CC=N2)C(=S)N)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC2=C(C=CC=N2)C(=S)N)C(C)(C)C

InChI

InChI=1S/C17H20N2OS/c1-11-7-8-14(13(10-11)17(2,3)4)20-16-12(15(18)21)6-5-9-19-16/h5-10H,1-4H3,(H2,18,21)