N-(2,6-dimethoxypyrimidin-4-yl)-4-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]benzenesulfonamide

Systemtic Name: N-(2,6-dimethoxypyrimidin-4-yl)-4-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]benzenesulfonamide Openeye Name: N-(2,6-dimethoxypyrimidin-4-yl)-4-[[4-(3-nitrophenyl)thiazol-2-yl]amino]benzenesulfonamide CAS Name: N-(2,6-dimethoxy-4-pyrimidinyl)-4-[[4-(3-nitrophenyl)-2-thiazolyl]amino]benzenesulfonamide IUPAC Name: N-(2,6-dimethoxypyrimidin-4-yl)-4-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]benzenesulfonamide Traditional Name: N-(2,6-dimethoxypyrimidin-4-yl)-4-[[4-(3-nitrophenyl)thiazol-2-yl]amino]benzenesulfonamide Formula: C21H18N6O6S2 MolecularWeight: 514.53422

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C21H18N6O6S2/c1-32-19-11-18(24-20(25-19)33-2)26-35(30,31)16-8-6-14(7-9-16)22-21-23-17(12-34-21)13-4-3-5-15(10-13)27(28)29/h3-12H,1-2H3,(H,22,23)(H,24,25,26)