2-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide

Systemtic Name: 2-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide Openeye Name: 2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide CAS Name: 2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methylthio]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide IUPAC Name: 2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide Traditional Name: 2-[(7-chloro-4-keto-1H-quinazolin-2-yl)methylthio]-N,N-dimethyl-1,3-benzoxazole-5-sulfonamide Formula: C18H15ClN4O4S2 MolecularWeight: 450.9191

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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=C(N3)C=C(C=C4)Cl

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C18H15ClN4O4S2/c1-23(2)29(25,26)11-4-6-15-14(8-11)21-18(27-15)28-9-16-20-13-7-10(19)3-5-12(13)17(24)22-16/h3-8H,9H2,1-2H3,(H,20,22,24)