N-(3,3-dimethylbutyl)-6-(phenylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(3,3-dimethylbutyl)-6-(phenylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: 6-benzylsulfanyl-N-(3,3-dimethylbutyl)pyridine-3-carboxamide CAS Name: N-(3,3-dimethylbutyl)-6-(phenylmethylthio)-3-pyridinecarboxamide IUPAC Name: 6-benzylsulfanyl-N-(3,3-dimethylbutyl)pyridine-3-carboxamide Traditional Name: 6-(benzylthio)-N-(3,3-dimethylbutyl)nicotinamide Formula: C19H24N2OS MolecularWeight: 328.47166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CCNC(=O)C1=CN=C(C=C1)SCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)CCNC(=O)C1=CN=C(C=C1)SCC2=CC=CC=C2

InChI

InChI=1S/C19H24N2OS/c1-19(2,3)11-12-20-18(22)16-9-10-17(21-13-16)23-14-15-7-5-4-6-8-15/h4-10,13H,11-12,14H2,1-3H3,(H,20,22)