propyl 4-[4-[(4-sulfamoylphenyl)amino]phthalazin-1-yl]benzoate

Systemtic Name: propyl 4-[4-[(4-sulfamoylphenyl)amino]phthalazin-1-yl]benzoate Openeye Name: propyl 4-[4-(4-sulfamoylanilino)phthalazin-1-yl]benzoate CAS Name: 4-[4-(4-sulfamoylanilino)-1-phthalazinyl]benzoic acid propyl ester IUPAC Name: propyl 4-[4-(4-sulfamoylanilino)phthalazin-1-yl]benzoate Traditional Name: 4-[4-(4-sulfamoylanilino)phthalazin-1-yl]benzoic acid propyl ester Formula: C24H22N4O4S MolecularWeight: 462.52088

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C24H22N4O4S/c1-2-15-32-24(29)17-9-7-16(8-10-17)22-20-5-3-4-6-21(20)23(28-27-22)26-18-11-13-19(14-12-18)33(25,30)31/h3-14H,2,15H2,1H3,(H,26,28)(H2,25,30,31)