3-[3-(3-oxidanyl-2-oxidanylidene-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-4-yl)propyl]oxepane-2,4,7-trione

Systemtic Name: 3-[3-(3-oxidanyl-2-oxidanylidene-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-4-yl)propyl]oxepane-2,4,7-trione Openeye Name: 3-[3-(3-hydroxy-2-oxo-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-4-yl)propyl]oxepane-2,4,7-trione CAS Name: 3-[3-(3-hydroxy-2-oxo-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-4-yl)propyl]oxepane-2,4,7-trione IUPAC Name: 3-[3-(3-hydroxy-2-oxo-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-4-yl)propyl]oxepane-2,4,7-trione Traditional Name: 3-[3-(3-hydroxy-2-keto-3a,4,6,6a-tetrahydro-1H-thien[3,4-d]imidazol-4-yl)propyl]oxepane-2,4,7-trione Formula: C14H18N2O6S MolecularWeight: 342.36752

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)OC(=O)C(C1=O)CCCC2C3C(CS2)NC(=O)N3O

Isomeric SMILES

C1CC(=O)OC(=O)C(C1=O)CCCC2C3C(CS2)NC(=O)N3O

InChI

InChI=1S/C14H18N2O6S/c17-9-4-5-11(18)22-13(19)7(9)2-1-3-10-12-8(6-23-10)15-14(20)16(12)21/h7-8,10,12,21H,1-6H2,(H,15,20)