2-oxidanyl-5-[1-oxidanyl-2-[4-(quinolin-3-ylmethylsulfanyl)butylamino]ethyl]benzamide

Systemtic Name: 2-oxidanyl-5-[1-oxidanyl-2-[4-(quinolin-3-ylmethylsulfanyl)butylamino]ethyl]benzamide Openeye Name: 2-hydroxy-5-[1-hydroxy-2-[4-(3-quinolylmethylsulfanyl)butylamino]ethyl]benzamide CAS Name: 2-hydroxy-5-[1-hydroxy-2-[4-(3-quinolinylmethylthio)butylamino]ethyl]benzamide IUPAC Name: 2-hydroxy-5-[1-hydroxy-2-[4-(quinolin-3-ylmethylsulfanyl)butylamino]ethyl]benzamide Traditional Name: 2-hydroxy-5-[1-hydroxy-2-[4-(3-quinolylmethylthio)butylamino]ethyl]benzamide Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=N2)CSCCCCNCC(C3=CC(=C(C=C3)O)C(=O)N)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=N2)CSCCCCNCC(C3=CC(=C(C=C3)O)C(=O)N)O

InChI

InChI=1S/C23H27N3O3S/c24-23(29)19-12-18(7-8-21(19)27)22(28)14-25-9-3-4-10-30-15-16-11-17-5-1-2-6-20(17)26-13-16/h1-2,5-8,11-13,22,25,27-28H,3-4,9-10,14-15H2,(H2,24,29)