2-[2-[[5-(dimethylsulfamoyl)-2-methyl-phenyl]amino]-2-oxidanylidene-ethyl]sulfanylquinazolin-4-olate

Systemtic Name: 2-[2-[[5-(dimethylsulfamoyl)-2-methyl-phenyl]amino]-2-oxidanylidene-ethyl]sulfanylquinazolin-4-olate Openeye Name: 2-[2-[5-(dimethylsulfamoyl)-2-methyl-anilino]-2-oxo-ethyl]sulfanylquinazolin-4-olate CAS Name: 2-[[2-[5-(dimethylsulfamoyl)-2-methylanilino]-2-oxoethyl]thio]-4-quinazolinolate IUPAC Name: 2-[2-[5-(dimethylsulfamoyl)-2-methylanilino]-2-oxoethyl]sulfanylquinazolin-4-olate Traditional Name: 2-[[2-[5-(dimethylsulfamoyl)-2-methyl-anilino]-2-keto-ethyl]thio]quinazolin-4-olate Formula: C19H19N4O4S2- MolecularWeight: 431.50856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=O)CSC2=NC3=CC=CC=C3C(=N2)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=O)CSC2=NC3=CC=CC=C3C(=N2)[O-]

InChI

InChI=1S/C19H20N4O4S2/c1-12-8-9-13(29(26,27)23(2)3)10-16(12)20-17(24)11-28-19-21-15-7-5-4-6-14(15)18(25)22-19/h4-10H,11H2,1-3H3,(H,20,24)(H,21,22,25)/p-1