5-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-[(4-nitrophenoxy)methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-[(4-nitrophenoxy)methyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-[(4-nitrophenoxy)methyl]isoxazole-3-carboxamide CAS Name: 5-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-[(4-nitrophenoxy)methyl]-3-isoxazolecarboxamide IUPAC Name: 5-methyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-4-[(4-nitrophenoxy)methyl]-1,2-oxazole-3-carboxamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-5-methyl-4-[(4-nitrophenoxy)methyl]isoxazole-3-carboxamide Formula: C20H16N4O7S2 MolecularWeight: 488.49364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C)COC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NO1)C(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C)COC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H16N4O7S2/c1-11-15(10-30-13-5-3-12(4-6-13)24(26)27)18(23-31-11)19(25)22-20-21-16-8-7-14(33(2,28)29)9-17(16)32-20/h3-9H,10H2,1-2H3,(H,21,22,25)