N,N-diethyl-4-[[5-nitro-6-[(4-propan-2-ylphenyl)amino]pyrimidin-4-yl]amino]benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[[5-nitro-6-[(4-propan-2-ylphenyl)amino]pyrimidin-4-yl]amino]benzenesulfonamide Openeye Name: N,N-diethyl-4-[[6-(4-isopropylanilino)-5-nitro-pyrimidin-4-yl]amino]benzenesulfonamide CAS Name: N,N-diethyl-4-[[5-nitro-6-(4-propan-2-ylanilino)-4-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: N,N-diethyl-4-[[5-nitro-6-(4-propan-2-ylanilino)pyrimidin-4-yl]amino]benzenesulfonamide Traditional Name: 4-[(6-cumidino-5-nitro-pyrimidin-4-yl)amino]-N,N-diethyl-benzenesulfonamide Formula: C23H28N6O4S MolecularWeight: 484.57122

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C23H28N6O4S/c1-5-28(6-2)34(32,33)20-13-11-19(12-14-20)27-23-21(29(30)31)22(24-15-25-23)26-18-9-7-17(8-10-18)16(3)4/h7-16H,5-6H2,1-4H3,(H2,24,25,26,27)