5-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1,2-oxazole-3-carboxamide Openeye Name: 5-(2-methyl-2,3-dihydrobenzofuran-5-yl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)isoxazole-3-carboxamide CAS Name: 5-(2-methyl-2,3-dihydrobenzofuran-5-yl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-isoxazolecarboxamide IUPAC Name: 5-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1,2-oxazole-3-carboxamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-5-(2-methylcoumaran-5-yl)isoxazole-3-carboxamide Formula: C21H17N3O5S2 MolecularWeight: 455.50678

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(O1)C=CC(=C2)C3=CC(=NO3)C(=O)NC4=NC5=C(S4)C=C(C=C5)S(=O)(=O)C

Isomeric SMILES

CC1CC2=C(O1)C=CC(=C2)C3=CC(=NO3)C(=O)NC4=NC5=C(S4)C=C(C=C5)S(=O)(=O)C

InChI

InChI=1S/C21H17N3O5S2/c1-11-7-13-8-12(3-6-17(13)28-11)18-10-16(24-29-18)20(25)23-21-22-15-5-4-14(31(2,26)27)9-19(15)30-21/h3-6,8-11H,7H2,1-2H3,(H,22,23,25)