4-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N,N-dimethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N,N-dimethyl-3-nitro-benzenesulfonamide Openeye Name: 4-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-N,N-dimethyl-3-nitro-benzenesulfonamide CAS Name: 4-[(3-ethyl-4-oxo-2-quinazolinyl)thio]-N,N-dimethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-(3-ethyl-4-oxoquinazolin-2-yl)sulfanyl-N,N-dimethyl-3-nitrobenzenesulfonamide Traditional Name: 4-[(3-ethyl-4-keto-quinazolin-2-yl)thio]-N,N-dimethyl-3-nitro-benzenesulfonamide Formula: C18H18N4O5S2 MolecularWeight: 434.48932

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SC3=C(C=C(C=C3)S(=O)(=O)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SC3=C(C=C(C=C3)S(=O)(=O)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O5S2/c1-4-21-17(23)13-7-5-6-8-14(13)19-18(21)28-16-10-9-12(11-15(16)22(24)25)29(26,27)20(2)3/h5-11H,4H2,1-3H3