2-[2-[[4-(dimethylsulfamoyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanylquinazolin-4-olate

Systemtic Name: 2-[2-[[4-(dimethylsulfamoyl)phenyl]amino]-2-oxidanylidene-ethyl]sulfanylquinazolin-4-olate Openeye Name: 2-[2-[4-(dimethylsulfamoyl)anilino]-2-oxo-ethyl]sulfanylquinazolin-4-olate CAS Name: 2-[[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl]thio]-4-quinazolinolate IUPAC Name: 2-[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl]sulfanylquinazolin-4-olate Traditional Name: 2-[[2-[4-(dimethylsulfamoyl)anilino]-2-keto-ethyl]thio]quinazolin-4-olate Formula: C18H17N4O4S2- MolecularWeight: 417.48198

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=N2)[O-]

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=N2)[O-]

InChI

InChI=1S/C18H18N4O4S2/c1-22(2)28(25,26)13-9-7-12(8-10-13)19-16(23)11-27-18-20-15-6-4-3-5-14(15)17(24)21-18/h3-10H,11H2,1-2H3,(H,19,23)(H,20,21,24)/p-1