2-chloranyl-N-[2-(4-ethylpiperazin-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]quinoline-4-carboxamide

Systemtic Name: 2-chloranyl-N-[2-(4-ethylpiperazin-1-yl)-5-morpholin-4-ylsulfonyl-phenyl]quinoline-4-carboxamide Openeye Name: 2-chloro-N-[2-(4-ethylpiperazin-1-yl)-5-morpholinosulfonyl-phenyl]quinoline-4-carboxamide CAS Name: 2-chloro-N-[2-(4-ethyl-1-piperazinyl)-5-(4-morpholinylsulfonyl)phenyl]-4-quinolinecarboxamide IUPAC Name: 2-chloro-N-[2-(4-ethylpiperazin-1-yl)-5-morpholin-4-ylsulfonylphenyl]quinoline-4-carboxamide Traditional Name: 2-chloro-N-[2-(4-ethylpiperazino)-5-morpholinosulfonyl-phenyl]cinchoninamide Formula: C26H30ClN5O4S MolecularWeight: 544.0655

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=CC(=NC5=CC=CC=C54)Cl

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=CC(=NC5=CC=CC=C54)Cl

InChI

InChI=1S/C26H30ClN5O4S/c1-2-30-9-11-31(12-10-30)24-8-7-19(37(34,35)32-13-15-36-16-14-32)17-23(24)29-26(33)21-18-25(27)28-22-6-4-3-5-20(21)22/h3-8,17-18H,2,9-16H2,1H3,(H,29,33)