8-chloranyl-N-[2-[4-(3-phenylsulfanylpropyl)piperazin-1-yl]ethyl]quinoline-5-sulfonamide

Systemtic Name: 8-chloranyl-N-[2-[4-(3-phenylsulfanylpropyl)piperazin-1-yl]ethyl]quinoline-5-sulfonamide Openeye Name: 8-chloro-N-[2-[4-(3-phenylsulfanylpropyl)piperazin-1-yl]ethyl]quinoline-5-sulfonamide CAS Name: 8-chloro-N-[2-[4-[3-(phenylthio)propyl]-1-piperazinyl]ethyl]-5-quinolinesulfonamide IUPAC Name: 8-chloro-N-[2-[4-(3-phenylsulfanylpropyl)piperazin-1-yl]ethyl]quinoline-5-sulfonamide Traditional Name: 8-chloro-N-[2-[4-[3-(phenylthio)propyl]piperazino]ethyl]quinoline-5-sulfonamide Formula: C24H29ClN4O2S2 MolecularWeight: 505.09566

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCSC2=CC=CC=C2)CCNS(=O)(=O)C3=C4C=CC=NC4=C(C=C3)Cl

Isomeric SMILES

C1CN(CCN1CCCSC2=CC=CC=C2)CCNS(=O)(=O)C3=C4C=CC=NC4=C(C=C3)Cl

InChI

InChI=1S/C24H29ClN4O2S2/c25-22-9-10-23(21-8-4-11-26-24(21)22)33(30,31)27-12-14-29-17-15-28(16-18-29)13-5-19-32-20-6-2-1-3-7-20/h1-4,6-11,27H,5,12-19H2