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N-(3-butylsulfanylpropyl)-2-phenylazanyl-quinoline-4-carboxamide

N-(3-butylsulfanylpropyl)-2-phenylazanyl-quinoline-4-carboxamide

Systemtic Name:N-(3-butylsulfanylpropyl)-2-phenylazanyl-quinoline-4-carboxamide
Openeye Name:2-anilino-N-(3-butylsulfanylpropyl)quinoline-4-carboxamide
CAS Name:2-anilino-N-[3-(butylthio)propyl]-4-quinolinecarboxamide
IUPAC Name:2-anilino-N-(3-butylsulfanylpropyl)quinoline-4-carboxamide
Traditional Name:2-anilino-N-[3-(butylthio)propyl]cinchoninamide
Formula: C23H27N3OS
MolecularWeight: 393.54498
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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCCCNC(=O)C1=CC(=NC2=CC=CC=C21)NC3=CC=CC=C3


Isomeric SMILES

CCCCSCCCNC(=O)C1=CC(=NC2=CC=CC=C21)NC3=CC=CC=C3


InChI

InChI=1S/C23H27N3OS/c1-2-3-15-28-16-9-14-24-23(27)20-17-22(25-18-10-5-4-6-11-18)26-21-13-8-7-12-19(20)21/h4-8,10-13,17H,2-3,9,14-16H2,1H3,(H,24,27)(H,25,26)


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