3-[(3-azanyl-3-oxidanylidene-propyl)sulfanyl-[3-[(7-chloranylquinolin-2-yl)methoxy]phenyl]methyl]sulfanylpropanamide

Systemtic Name: 3-[(3-azanyl-3-oxidanylidene-propyl)sulfanyl-[3-[(7-chloranylquinolin-2-yl)methoxy]phenyl]methyl]sulfanylpropanamide Openeye Name: 3-[(3-amino-3-oxo-propyl)sulfanyl-[3-[(7-chloro-2-quinolyl)methoxy]phenyl]methyl]sulfanylpropanamide CAS Name: 3-[[[(3-amino-3-oxopropyl)thio]-[3-[(7-chloro-2-quinolinyl)methoxy]phenyl]methyl]thio]propanamide IUPAC Name: 3-[(3-amino-3-oxopropyl)sulfanyl-[3-[(7-chloroquinolin-2-yl)methoxy]phenyl]methyl]sulfanylpropanamide Traditional Name: 3-[[[(3-amino-3-keto-propyl)thio]-[3-[(7-chloro-2-quinolyl)methoxy]phenyl]methyl]thio]propionamide Formula: C23H24ClN3O3S2 MolecularWeight: 490.03796

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCC2=NC3=C(C=CC(=C3)Cl)C=C2)C(SCCC(=O)N)SCCC(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)OCC2=NC3=C(C=CC(=C3)Cl)C=C2)C(SCCC(=O)N)SCCC(=O)N

InChI

InChI=1S/C23H24ClN3O3S2/c24-17-6-4-15-5-7-18(27-20(15)13-17)14-30-19-3-1-2-16(12-19)23(31-10-8-21(25)28)32-11-9-22(26)29/h1-7,12-13,23H,8-11,14H2,(H2,25,28)(H2,26,29)