N,N-diethyl-4-[[(3-nitro-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)amino]methyl]benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[[(3-nitro-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)amino]methyl]benzenesulfonamide Openeye Name: N,N-diethyl-4-[[(3-nitro-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)amino]methyl]benzenesulfonamide CAS Name: N,N-diethyl-4-[[(3-nitro-4-oxo-2-pyrido[1,2-a]pyrimidinyl)amino]methyl]benzenesulfonamide IUPAC Name: N,N-diethyl-4-[[(3-nitro-4-oxopyrido[1,2-a]pyrimidin-2-yl)amino]methyl]benzenesulfonamide Traditional Name: N,N-diethyl-4-[[(4-keto-3-nitro-pyrido[1,2-a]pyrimidin-2-yl)amino]methyl]benzenesulfonamide Formula: C19H21N5O5S MolecularWeight: 431.46554

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)CNC2=C(C(=O)N3C=CC=CC3=N2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)CNC2=C(C(=O)N3C=CC=CC3=N2)[N+](=O)[O-]

InChI

InChI=1S/C19H21N5O5S/c1-3-22(4-2)30(28,29)15-10-8-14(9-11-15)13-20-18-17(24(26)27)19(25)23-12-6-5-7-16(23)21-18/h5-12,20H,3-4,13H2,1-2H3