N-(4-butan-2-ylphenyl)-2-methylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-(4-butan-2-ylphenyl)-2-methylsulfanyl-pyridine-3-carboxamide Openeye Name: 2-methylsulfanyl-N-(4-sec-butylphenyl)pyridine-3-carboxamide CAS Name: N-(4-butan-2-ylphenyl)-2-(methylthio)-3-pyridinecarboxamide IUPAC Name: N-(4-butan-2-ylphenyl)-2-methylsulfanylpyridine-3-carboxamide Traditional Name: 2-(methylthio)-N-(4-sec-butylphenyl)nicotinamide Formula: C17H20N2OS MolecularWeight: 300.4185

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC(=O)C2=C(N=CC=C2)SC

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC(=O)C2=C(N=CC=C2)SC

InChI

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