N-(2-tert-butylphenyl)-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-(2-tert-butylphenyl)-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: N-(2-tert-butylphenyl)-2-methylsulfanyl-pyridine-3-carboxamide CAS Name: N-(2-tert-butylphenyl)-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-(2-tert-butylphenyl)-2-methylsulfanylpyridine-3-carboxamide Traditional Name: N-(2-tert-butylphenyl)-2-(methylthio)nicotinamide Formula: C17H20N2OS MolecularWeight: 300.4185

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1NC(=O)C2=C(N=CC=C2)SC

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1NC(=O)C2=C(N=CC=C2)SC

InChI

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