2-[2-[[2,6-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanyl-N-cyclopropyl-quinoline-4-carboxamide

Systemtic Name: 2-[2-[[2,6-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanyl-N-cyclopropyl-quinoline-4-carboxamide Openeye Name: N-cyclopropyl-2-[2-(2,6-dichloroanilino)-2-oxo-ethyl]sulfanyl-quinoline-4-carboxamide CAS Name: N-cyclopropyl-2-[[2-(2,6-dichloroanilino)-2-oxoethyl]thio]-4-quinolinecarboxamide IUPAC Name: N-cyclopropyl-2-[2-(2,6-dichloroanilino)-2-oxoethyl]sulfanylquinoline-4-carboxamide Traditional Name: N-cyclopropyl-2-[[2-(2,6-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=C4Cl)Cl

Isomeric SMILES

C1CC1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)NC4=C(C=CC=C4Cl)Cl

InChI

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