2-[2-[[2,5-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanyl-N-cyclopropyl-quinoline-4-carboxamide

Systemtic Name: 2-[2-[[2,5-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanyl-N-cyclopropyl-quinoline-4-carboxamide Openeye Name: N-cyclopropyl-2-[2-(2,5-dichloroanilino)-2-oxo-ethyl]sulfanyl-quinoline-4-carboxamide CAS Name: N-cyclopropyl-2-[[2-(2,5-dichloroanilino)-2-oxoethyl]thio]-4-quinolinecarboxamide IUPAC Name: N-cyclopropyl-2-[2-(2,5-dichloroanilino)-2-oxoethyl]sulfanylquinoline-4-carboxamide Traditional Name: N-cyclopropyl-2-[[2-(2,5-dichloroanilino)-2-keto-ethyl]thio]cinchoninamide Formula: C21H17Cl2N3O2S MolecularWeight: 446.34958

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)NC4=C(C=CC(=C4)Cl)Cl

Isomeric SMILES

C1CC1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)NC4=C(C=CC(=C4)Cl)Cl

InChI

InChI=1S/C21H17Cl2N3O2S/c22-12-5-8-16(23)18(9-12)25-19(27)11-29-20-10-15(21(28)24-13-6-7-13)14-3-1-2-4-17(14)26-20/h1-5,8-10,13H,6-7,11H2,(H,24,28)(H,25,27)