N-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanamide

Systemtic Name: N-(2-methoxy-5-morpholin-4-ylsulfonyl-phenyl)-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanamide Openeye Name: N-(2-methoxy-5-morpholinosulfonyl-phenyl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide CAS Name: N-[2-methoxy-5-(4-morpholinylsulfonyl)phenyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide IUPAC Name: N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide Traditional Name: 2-(4-keto-1,2,3-benzotriazin-3-yl)-N-(2-methoxy-5-morpholinosulfonyl-phenyl)acetamide Formula: C20H21N5O6S MolecularWeight: 459.47564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H21N5O6S/c1-30-18-7-6-14(32(28,29)24-8-10-31-11-9-24)12-17(18)21-19(26)13-25-20(27)15-4-2-3-5-16(15)22-23-25/h2-7,12H,8-11,13H2,1H3,(H,21,26)