4-[(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)methyl]-1,4-benzoxazin-3-one

Systemtic Name: 4-[(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)methyl]-1,4-benzoxazin-3-one Openeye Name: 4-[(2-thioxo-3H-1,3,4-oxadiazol-5-yl)methyl]-1,4-benzoxazin-3-one CAS Name: 4-[(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)methyl]-1,4-benzoxazin-3-one IUPAC Name: 4-[(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)methyl]-1,4-benzoxazin-3-one Traditional Name: 4-[(2-thioxo-3H-1,3,4-oxadiazol-5-yl)methyl]-1,4-benzoxazin-3-one Formula: C11H9N3O3S MolecularWeight: 263.27246

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=CC=CC=C2O1)CC3=NNC(=S)O3

Isomeric SMILES

C1C(=O)N(C2=CC=CC=C2O1)CC3=NNC(=S)O3

InChI

InChI=1S/C11H9N3O3S/c15-10-6-16-8-4-2-1-3-7(8)14(10)5-9-12-13-11(18)17-9/h1-4H,5-6H2,(H,13,18)