6-bromanyl-N-[(Z)-1-(5-chloranylthiophen-2-yl)butylideneamino]-2-cyclopropyl-quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-[(Z)-1-(5-chloranylthiophen-2-yl)butylideneamino]-2-cyclopropyl-quinoline-4-carboxamide Openeye Name: 6-bromo-N-[(Z)-1-(5-chloro-2-thienyl)butylideneamino]-2-cyclopropyl-quinoline-4-carboxamide CAS Name: 6-bromo-N-[(Z)-1-(5-chloro-2-thiophenyl)butylideneamino]-2-cyclopropyl-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-[(Z)-1-(5-chlorothiophen-2-yl)butylideneamino]-2-cyclopropylquinoline-4-carboxamide Traditional Name: 6-bromo-N-[(Z)-1-(5-chloro-2-thienyl)butylideneamino]-2-cyclopropyl-cinchoninamide Formula: C21H19BrClN3OS MolecularWeight: 476.81706

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=NNC(=O)C1=CC(=NC2=C1C=C(C=C2)Br)C3CC3)C4=CC=C(S4)Cl

Isomeric SMILES

CCC/C(=N/NC(=O)C1=CC(=NC2=C1C=C(C=C2)Br)C3CC3)/C4=CC=C(S4)Cl

InChI

InChI=1S/C21H19BrClN3OS/c1-2-3-17(19-8-9-20(23)28-19)25-26-21(27)15-11-18(12-4-5-12)24-16-7-6-13(22)10-14(15)16/h6-12H,2-5H2,1H3,(H,26,27)/b25-17-