3-[4-[3-(1-oxidanylidenephthalazin-2-yl)propoxy]phenyl]-2-propylsulfanyl-propanamide

Systemtic Name: 3-[4-[3-(1-oxidanylidenephthalazin-2-yl)propoxy]phenyl]-2-propylsulfanyl-propanamide Openeye Name: 3-[4-[3-(1-oxophthalazin-2-yl)propoxy]phenyl]-2-propylsulfanyl-propanamide CAS Name: 3-[4-[3-(1-oxo-2-phthalazinyl)propoxy]phenyl]-2-(propylthio)propanamide IUPAC Name: 3-[4-[3-(1-oxophthalazin-2-yl)propoxy]phenyl]-2-propylsulfanylpropanamide Traditional Name: 3-[4-[3-(1-ketophthalazin-2-yl)propoxy]phenyl]-2-(propylthio)propionamide Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC(CC1=CC=C(C=C1)OCCCN2C(=O)C3=CC=CC=C3C=N2)C(=O)N

Isomeric SMILES

CCCSC(CC1=CC=C(C=C1)OCCCN2C(=O)C3=CC=CC=C3C=N2)C(=O)N

InChI

InChI=1S/C23H27N3O3S/c1-2-14-30-21(22(24)27)15-17-8-10-19(11-9-17)29-13-5-12-26-23(28)20-7-4-3-6-18(20)16-25-26/h3-4,6-11,16,21H,2,5,12-15H2,1H3,(H2,24,27)