4,5,6-trimethyl-2-[2-oxidanylidene-2-(quinolin-5-ylamino)ethyl]sulfanyl-pyridine-3-carboxamide

Systemtic Name: 4,5,6-trimethyl-2-[2-oxidanylidene-2-(quinolin-5-ylamino)ethyl]sulfanyl-pyridine-3-carboxamide Openeye Name: 4,5,6-trimethyl-2-[2-oxo-2-(5-quinolylamino)ethyl]sulfanyl-pyridine-3-carboxamide CAS Name: 4,5,6-trimethyl-2-[[2-oxo-2-(5-quinolinylamino)ethyl]thio]-3-pyridinecarboxamide IUPAC Name: 4,5,6-trimethyl-2-[2-oxo-2-(quinolin-5-ylamino)ethyl]sulfanylpyridine-3-carboxamide Traditional Name: 2-[[2-keto-2-(5-quinolylamino)ethyl]thio]-4,5,6-trimethyl-nicotinamide Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C(=O)N)SCC(=O)NC2=CC=CC3=C2C=CC=N3)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C(=O)N)SCC(=O)NC2=CC=CC3=C2C=CC=N3)C

InChI

InChI=1S/C20H20N4O2S/c1-11-12(2)18(19(21)26)20(23-13(11)3)27-10-17(25)24-16-8-4-7-15-14(16)6-5-9-22-15/h4-9H,10H2,1-3H3,(H2,21,26)(H,24,25)