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

Systemtic Name: 2-[2-[(2-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-pentyl-pyridine-3-carboxamide Openeye Name: 2-[2-(2-methoxyanilino)-2-oxo-ethyl]sulfanyl-N-pentyl-pyridine-3-carboxamide CAS Name: 2-[[2-(2-methoxyanilino)-2-oxoethyl]thio]-N-pentyl-3-pyridinecarboxamide IUPAC Name: 2-[2-(2-methoxyanilino)-2-oxoethyl]sulfanyl-N-pentylpyridine-3-carboxamide Traditional Name: N-amyl-2-[[2-keto-2-(o-anisidino)ethyl]thio]nicotinamide Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O3S/c1-3-4-7-12-21-19(25)15-9-8-13-22-20(15)27-14-18(24)23-16-10-5-6-11-17(16)26-2/h5-6,8-11,13H,3-4,7,12,14H2,1-2H3,(H,21,25)(H,23,24)