2-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoylamino]-N-[(4-sulfamoylphenyl)methyl]propanamide

Systemtic Name: 2-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoylamino]-N-[(4-sulfamoylphenyl)methyl]propanamide Openeye Name: 2-[[2-(4-oxo-3H-phthalazin-1-yl)acetyl]amino]-N-[(4-sulfamoylphenyl)methyl]propanamide CAS Name: 2-[[1-oxo-2-(4-oxo-3H-phthalazin-1-yl)ethyl]amino]-N-[(4-sulfamoylphenyl)methyl]propanamide IUPAC Name: 2-[[2-(4-oxo-3H-phthalazin-1-yl)acetyl]amino]-N-[(4-sulfamoylphenyl)methyl]propanamide Traditional Name: 2-[[2-(4-keto-3H-phthalazin-1-yl)acetyl]amino]-N-(4-sulfamoylbenzyl)propionamide Formula: C20H21N5O5S MolecularWeight: 443.47624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)S(=O)(=O)N)NC(=O)CC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC(C(=O)NCC1=CC=C(C=C1)S(=O)(=O)N)NC(=O)CC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C20H21N5O5S/c1-12(19(27)22-11-13-6-8-14(9-7-13)31(21,29)30)23-18(26)10-17-15-4-2-3-5-16(15)20(28)25-24-17/h2-9,12H,10-11H2,1H3,(H,22,27)(H,23,26)(H,25,28)(H2,21,29,30)