N,N-dimethyl-2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-1,3-benzoxazole-5-sulfonamide

Systemtic Name: N,N-dimethyl-2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-1,3-benzoxazole-5-sulfonamide Openeye Name: N,N-dimethyl-2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-1,3-benzoxazole-5-sulfonamide CAS Name: N,N-dimethyl-2-[(4-oxo-1H-quinazolin-2-yl)methylthio]-1,3-benzoxazole-5-sulfonamide IUPAC Name: N,N-dimethyl-2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-1,3-benzoxazole-5-sulfonamide Traditional Name: 2-[(4-keto-1H-quinazolin-2-yl)methylthio]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide Formula: C18H16N4O4S2 MolecularWeight: 416.47404

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C18H16N4O4S2/c1-22(2)28(24,25)11-7-8-15-14(9-11)20-18(26-15)27-10-16-19-13-6-4-3-5-12(13)17(23)21-16/h3-9H,10H2,1-2H3,(H,19,21,23)