N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-2-(3,4-dimethylphenyl)sulfanyl-N-methyl-pyridine-3-carboxamide

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-2-(3,4-dimethylphenyl)sulfanyl-N-methyl-pyridine-3-carboxamide Openeye Name: N-[2-(tert-butylamino)-2-oxo-ethyl]-2-(3,4-dimethylphenyl)sulfanyl-N-methyl-pyridine-3-carboxamide CAS Name: N-[2-(tert-butylamino)-2-oxoethyl]-2-[(3,4-dimethylphenyl)thio]-N-methyl-3-pyridinecarboxamide IUPAC Name: N-[2-(tert-butylamino)-2-oxoethyl]-2-(3,4-dimethylphenyl)sulfanyl-N-methylpyridine-3-carboxamide Traditional Name: N-[2-(tert-butylamino)-2-keto-ethyl]-2-[(3,4-dimethylphenyl)thio]-N-methyl-nicotinamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)N(C)CC(=O)NC(C)(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)SC2=C(C=CC=N2)C(=O)N(C)CC(=O)NC(C)(C)C)C

InChI

InChI=1S/C21H27N3O2S/c1-14-9-10-16(12-15(14)2)27-19-17(8-7-11-22-19)20(26)24(6)13-18(25)23-21(3,4)5/h7-12H,13H2,1-6H3,(H,23,25)