2-[2-[(2-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-octyl-pyridine-3-carboxamide

Systemtic Name: 2-[2-[(2-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-octyl-pyridine-3-carboxamide Openeye Name: 2-[2-(2-methoxyanilino)-2-oxo-ethyl]sulfanyl-N-octyl-pyridine-3-carboxamide CAS Name: 2-[[2-(2-methoxyanilino)-2-oxoethyl]thio]-N-octyl-3-pyridinecarboxamide IUPAC Name: 2-[2-(2-methoxyanilino)-2-oxoethyl]sulfanyl-N-octylpyridine-3-carboxamide Traditional Name: 2-[[2-keto-2-(o-anisidino)ethyl]thio]-N-octyl-nicotinamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C1=C(N=CC=C1)SCC(=O)NC2=CC=CC=C2OC

Isomeric SMILES

CCCCCCCCNC(=O)C1=C(N=CC=C1)SCC(=O)NC2=CC=CC=C2OC

InChI

InChI=1S/C23H31N3O3S/c1-3-4-5-6-7-10-15-24-22(28)18-12-11-16-25-23(18)30-17-21(27)26-19-13-8-9-14-20(19)29-2/h8-9,11-14,16H,3-7,10,15,17H2,1-2H3,(H,24,28)(H,26,27)