methyl 4-methoxy-5-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propylsulfamoyl]thiophene-3-carboxylate

Systemtic Name: methyl 4-methoxy-5-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)amino]propylsulfamoyl]thiophene-3-carboxylate Openeye Name: methyl 4-methoxy-5-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propylsulfamoyl]thiophene-3-carboxylate CAS Name: 4-methoxy-5-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propylsulfamoyl]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-methoxy-5-[3-[(4-oxo-3H-phthalazin-1-yl)amino]propylsulfamoyl]thiophene-3-carboxylate Traditional Name: 5-[3-[(4-keto-3H-phthalazin-1-yl)amino]propylsulfamoyl]-4-methoxy-thiophene-3-carboxylic acid methyl ester Formula: C18H20N4O6S2 MolecularWeight: 452.5046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(SC=C1C(=O)OC)S(=O)(=O)NCCCNC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

COC1=C(SC=C1C(=O)OC)S(=O)(=O)NCCCNC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C18H20N4O6S2/c1-27-14-13(17(24)28-2)10-29-18(14)30(25,26)20-9-5-8-19-15-11-6-3-4-7-12(11)16(23)22-21-15/h3-4,6-7,10,20H,5,8-9H2,1-2H3,(H,19,21)(H,22,23)