2-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]sulfanylquinoline-4-carboxamide

Systemtic Name: 2-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]sulfanylquinoline-4-carboxamide Openeye Name: 2-[2-oxo-2-(sec-butylamino)ethyl]sulfanylquinoline-4-carboxamide CAS Name: 2-[[2-(butan-2-ylamino)-2-oxoethyl]thio]-4-quinolinecarboxamide IUPAC Name: 2-[2-(butan-2-ylamino)-2-oxoethyl]sulfanylquinoline-4-carboxamide Traditional Name: 2-[[2-keto-2-(sec-butylamino)ethyl]thio]cinchoninamide Formula: C16H19N3O2S MolecularWeight: 317.40596

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CSC1=NC2=CC=CC=C2C(=C1)C(=O)N

Isomeric SMILES

CCC(C)NC(=O)CSC1=NC2=CC=CC=C2C(=C1)C(=O)N

InChI

InChI=1S/C16H19N3O2S/c1-3-10(2)18-14(20)9-22-15-8-12(16(17)21)11-6-4-5-7-13(11)19-15/h4-8,10H,3,9H2,1-2H3,(H2,17,21)(H,18,20)