N-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]acetamide CAS Name: N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]acetamide Traditional Name: 2-(benzylthio)-N-[3-[(4-keto-3H-phthalazin-1-yl)amino]propyl]acetamide Formula: C20H22N4O2S MolecularWeight: 382.47928

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCC(=O)NCCCNC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

C1=CC=C(C=C1)CSCC(=O)NCCCNC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C20H22N4O2S/c25-18(14-27-13-15-7-2-1-3-8-15)21-11-6-12-22-19-16-9-4-5-10-17(16)20(26)24-23-19/h1-5,7-10H,6,11-14H2,(H,21,25)(H,22,23)(H,24,26)