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

Systemtic Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]benzenesulfonamide Openeye Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[[4-(3-nitrophenyl)thiazol-2-yl]amino]benzenesulfonamide CAS Name: N-(4,6-dimethyl-2-pyrimidinyl)-4-[[4-(3-nitrophenyl)-2-thiazolyl]amino]benzenesulfonamide IUPAC Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]benzenesulfonamide Traditional Name: N-(4,6-dimethylpyrimidin-2-yl)-4-[[4-(3-nitrophenyl)thiazol-2-yl]amino]benzenesulfonamide Formula: C21H18N6O4S2 MolecularWeight: 482.53542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C21H18N6O4S2/c1-13-10-14(2)23-20(22-13)26-33(30,31)18-8-6-16(7-9-18)24-21-25-19(12-32-21)15-4-3-5-17(11-15)27(28)29/h3-12H,1-2H3,(H,24,25)(H,22,23,26)