4,6-dimethyl-2-[2-oxidanylidene-2-[(3-piperidin-1-ylsulfonylphenyl)amino]ethyl]sulfanyl-pyridine-3-carboxamide

Systemtic Name: 4,6-dimethyl-2-[2-oxidanylidene-2-[(3-piperidin-1-ylsulfonylphenyl)amino]ethyl]sulfanyl-pyridine-3-carboxamide Openeye Name: 4,6-dimethyl-2-[2-oxo-2-[3-(1-piperidylsulfonyl)anilino]ethyl]sulfanyl-pyridine-3-carboxamide CAS Name: 4,6-dimethyl-2-[[2-oxo-2-[3-(1-piperidinylsulfonyl)anilino]ethyl]thio]-3-pyridinecarboxamide IUPAC Name: 4,6-dimethyl-2-[2-oxo-2-(3-piperidin-1-ylsulfonylanilino)ethyl]sulfanylpyridine-3-carboxamide Traditional Name: 2-[[2-keto-2-(3-piperidinosulfonylanilino)ethyl]thio]-4,6-dimethyl-nicotinamide Formula: C21H26N4O4S2 MolecularWeight: 462.58554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C(=O)N)SCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)C

Isomeric SMILES

CC1=CC(=NC(=C1C(=O)N)SCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)C

InChI

InChI=1S/C21H26N4O4S2/c1-14-11-15(2)23-21(19(14)20(22)27)30-13-18(26)24-16-7-6-8-17(12-16)31(28,29)25-9-4-3-5-10-25/h6-8,11-12H,3-5,9-10,13H2,1-2H3,(H2,22,27)(H,24,26)