N-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: N-(4-methoxy-3-morpholinosulfonyl-phenyl)-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: N-[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-mesyl-N-(4-methoxy-3-morpholinosulfonyl-phenyl)-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C21H25N3O8S2 MolecularWeight: 511.5685

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2CN(C3=CC=CC=C3O2)S(=O)(=O)C)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C21H25N3O8S2/c1-30-18-8-7-15(13-20(18)34(28,29)23-9-11-31-12-10-23)22-21(25)19-14-24(33(2,26)27)16-5-3-4-6-17(16)32-19/h3-8,13,19H,9-12,14H2,1-2H3,(H,22,25)