2-[2-[2-(4-chloranylphenoxy)ethylamino]-2-oxidanylidene-ethyl]sulfanyl-N-cyclopropyl-quinoline-4-carboxamide

Systemtic Name: 2-[2-[2-(4-chloranylphenoxy)ethylamino]-2-oxidanylidene-ethyl]sulfanyl-N-cyclopropyl-quinoline-4-carboxamide Openeye Name: 2-[2-[2-(4-chlorophenoxy)ethylamino]-2-oxo-ethyl]sulfanyl-N-cyclopropyl-quinoline-4-carboxamide CAS Name: 2-[[2-[2-(4-chlorophenoxy)ethylamino]-2-oxoethyl]thio]-N-cyclopropyl-4-quinolinecarboxamide IUPAC Name: 2-[2-[2-(4-chlorophenoxy)ethylamino]-2-oxoethyl]sulfanyl-N-cyclopropylquinoline-4-carboxamide Traditional Name: 2-[[2-[2-(4-chlorophenoxy)ethylamino]-2-keto-ethyl]thio]-N-cyclopropyl-cinchoninamide Formula: C23H22ClN3O3S MolecularWeight: 455.95708

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)NCCOC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CC1NC(=O)C2=CC(=NC3=CC=CC=C32)SCC(=O)NCCOC4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H22ClN3O3S/c24-15-5-9-17(10-6-15)30-12-11-25-21(28)14-31-22-13-19(23(29)26-16-7-8-16)18-3-1-2-4-20(18)27-22/h1-6,9-10,13,16H,7-8,11-12,14H2,(H,25,28)(H,26,29)