2-[2-(tert-butylamino)-2-oxidanylidene-ethyl]sulfanyl-4,6-dimethyl-N-phenyl-pyridine-3-carboxamide

Systemtic Name: 2-[2-(tert-butylamino)-2-oxidanylidene-ethyl]sulfanyl-4,6-dimethyl-N-phenyl-pyridine-3-carboxamide Openeye Name: 2-[2-(tert-butylamino)-2-oxo-ethyl]sulfanyl-4,6-dimethyl-N-phenyl-pyridine-3-carboxamide CAS Name: 2-[[2-(tert-butylamino)-2-oxoethyl]thio]-4,6-dimethyl-N-phenyl-3-pyridinecarboxamide IUPAC Name: 2-[2-(tert-butylamino)-2-oxoethyl]sulfanyl-4,6-dimethyl-N-phenylpyridine-3-carboxamide Traditional Name: 2-[[2-(tert-butylamino)-2-keto-ethyl]thio]-4,6-dimethyl-N-phenyl-nicotinamide Formula: C20H25N3O2S MolecularWeight: 371.4964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C(=O)NC2=CC=CC=C2)SCC(=O)NC(C)(C)C)C

Isomeric SMILES

CC1=CC(=NC(=C1C(=O)NC2=CC=CC=C2)SCC(=O)NC(C)(C)C)C

InChI

InChI=1S/C20H25N3O2S/c1-13-11-14(2)21-19(26-12-16(24)23-20(3,4)5)17(13)18(25)22-15-9-7-6-8-10-15/h6-11H,12H2,1-5H3,(H,22,25)(H,23,24)