N-[(E)-(7-methoxy-2-oxidanylidene-1,3-benzoxathiol-5-yl)methylideneamino]-2-(2-oxidanylidene-4-phenyl-pyrrolidin-1-yl)ethanamide

Systemtic Name: N-[(E)-(7-methoxy-2-oxidanylidene-1,3-benzoxathiol-5-yl)methylideneamino]-2-(2-oxidanylidene-4-phenyl-pyrrolidin-1-yl)ethanamide Openeye Name: N-[(E)-(7-methoxy-2-oxo-1,3-benzoxathiol-5-yl)methyleneamino]-2-(2-oxo-4-phenyl-pyrrolidin-1-yl)acetamide CAS Name: N-[(E)-(7-methoxy-2-oxo-1,3-benzoxathiol-5-yl)methylideneamino]-2-(2-oxo-4-phenyl-1-pyrrolidinyl)acetamide IUPAC Name: N-[(E)-(7-methoxy-2-oxo-1,3-benzoxathiol-5-yl)methylideneamino]-2-(2-oxo-4-phenylpyrrolidin-1-yl)acetamide Traditional Name: N-[(E)-(2-keto-7-methoxy-1,3-benzoxathiol-5-yl)methyleneamino]-2-(2-keto-4-phenyl-pyrrolidino)acetamide Formula: C21H19N3O5S MolecularWeight: 425.45766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1)C=NNC(=O)CN3CC(CC3=O)C4=CC=CC=C4)SC(=O)O2

Isomeric SMILES

COC1=C2C(=CC(=C1)/C=N/NC(=O)CN3CC(CC3=O)C4=CC=CC=C4)SC(=O)O2

InChI

InChI=1S/C21H19N3O5S/c1-28-16-7-13(8-17-20(16)29-21(27)30-17)10-22-23-18(25)12-24-11-15(9-19(24)26)14-5-3-2-4-6-14/h2-8,10,15H,9,11-12H2,1H3,(H,23,25)/b22-10+