2-[(4-methylphenyl)sulfonylamino]-N-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]-3-phenyl-propanamide

Systemtic Name: 2-[(4-methylphenyl)sulfonylamino]-N-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propyl]-3-phenyl-propanamide Openeye Name: N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-3-phenyl-2-(p-tolylsulfonylamino)propanamide CAS Name: 2-[(4-methylphenyl)sulfonylamino]-N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-3-phenylpropanamide IUPAC Name: 2-[(4-methylphenyl)sulfonylamino]-N-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propyl]-3-phenylpropanamide Traditional Name: N-[3-[(4-keto-3H-phthalazin-1-yl)amino]propyl]-3-phenyl-2-(tosylamino)propionamide Formula: C27H29N5O4S MolecularWeight: 519.61526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)NCCCNC3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)NCCCNC3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C27H29N5O4S/c1-19-12-14-21(15-13-19)37(35,36)32-24(18-20-8-3-2-4-9-20)27(34)29-17-7-16-28-25-22-10-5-6-11-23(22)26(33)31-30-25/h2-6,8-15,24,32H,7,16-18H2,1H3,(H,28,30)(H,29,34)(H,31,33)