6-(2-tert-butyl-4-methyl-phenoxy)pyridine-3-carbothioamide

Systemtic Name: 6-(2-tert-butyl-4-methyl-phenoxy)pyridine-3-carbothioamide Openeye Name: 6-(2-tert-butyl-4-methyl-phenoxy)pyridine-3-carbothioamide CAS Name: 6-(2-tert-butyl-4-methylphenoxy)-3-pyridinecarbothioamide IUPAC Name: 6-(2-tert-butyl-4-methylphenoxy)pyridine-3-carbothioamide Traditional Name: 6-(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=NC=C(C=C2)C(=S)N)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC2=NC=C(C=C2)C(=S)N)C(C)(C)C

InChI

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