N-[6-(2-methoxyethylamino)-7-nitro-2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]methanesulfonamide

Systemtic Name: N-[6-(2-methoxyethylamino)-7-nitro-2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]methanesulfonamide Openeye Name: N-[6-(2-methoxyethylamino)-7-nitro-2,4-dioxo-1H-quinazolin-3-yl]methanesulfonamide CAS Name: N-[6-(2-methoxyethylamino)-7-nitro-2,4-dioxo-1H-quinazolin-3-yl]methanesulfonamide IUPAC Name: N-[6-(2-methoxyethylamino)-7-nitro-2,4-dioxo-1H-quinazolin-3-yl]methanesulfonamide Traditional Name: N-[2,4-diketo-6-(2-methoxyethylamino)-7-nitro-1H-quinazolin-3-yl]methanesulfonamide Formula: C12H15N5O7S MolecularWeight: 373.3418

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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=C2C(=C1)C(=O)N(C(=O)N2)NS(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

COCCNC1=C(C=C2C(=C1)C(=O)N(C(=O)N2)NS(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C12H15N5O7S/c1-24-4-3-13-9-5-7-8(6-10(9)17(20)21)14-12(19)16(11(7)18)15-25(2,22)23/h5-6,13,15H,3-4H2,1-2H3,(H,14,19)