4-[(2,6-dimethoxypyridin-4-yl)methyl]-6-[(E)-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,4-benzoxazin-3-one

Systemtic Name: 4-[(2,6-dimethoxypyridin-4-yl)methyl]-6-[(E)-(4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,4-benzoxazin-3-one Openeye Name: 4-[(2,6-dimethoxy-4-pyridyl)methyl]-6-[(E)-(4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]-1,4-benzoxazin-3-one CAS Name: 4-[(2,6-dimethoxy-4-pyridinyl)methyl]-6-[(E)-(4-oxo-2-sulfanylidene-5-thiazolidinylidene)methyl]-1,4-benzoxazin-3-one IUPAC Name: 4-[(2,6-dimethoxypyridin-4-yl)methyl]-6-[(E)-(4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]-1,4-benzoxazin-3-one Traditional Name: 4-[(2,6-dimethoxy-4-pyridyl)methyl]-6-[(E)-(4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]-1,4-benzoxazin-3-one Formula: C20H17N3O5S2 MolecularWeight: 443.49608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=N1)OC)CN2C(=O)COC3=C2C=C(C=C3)C=C4C(=O)NC(=S)S4

Isomeric SMILES

COC1=CC(=CC(=N1)OC)CN2C(=O)COC3=C2C=C(C=C3)/C=C/4\C(=O)NC(=S)S4

InChI

InChI=1S/C20H17N3O5S2/c1-26-16-7-12(8-17(21-16)27-2)9-23-13-5-11(3-4-14(13)28-10-18(23)24)6-15-19(25)22-20(29)30-15/h3-8H,9-10H2,1-2H3,(H,22,25,29)/b15-6+