Vitas-M small molecule compound
8-(3-nitrophenyl)-7,9-dioxa-1-thia-3-azaspiro[4.5]decane-2,4-dione
Catalog ID
STL171364
SMILES O=C1NC(=O)C2(S1)COC(OC2)c1cccc(c1)[N+](=O)[O-]
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C12H10N2O6S MW 310.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10N2O6S/c15-10-12(21-11(16)13-10)5-19-9(20-6-12)7-2-1-3-8(4-7)14(17)18/h1-4,9H,5-6H2,(H,13,15,16)InChIKey
UXILJLKYQVUAKZ-UHFFFAOYSA-NSynonyms
8(3nitrophenyl)79dioxa1thia3azaspiro(45)decane24dione
8(3NITROPHENYL)79DIOXA4THIA2AZASPIRO(45)DECANE13DIONE
C1C2(COC(O1)C3=CC(=CC=C3)(N+)(=O)(O))C(=O)NC(=O)S2
InChI=1SC12H10N2O6Sc151012(2111(16)1310)5199(20612)72138(47)14(17)18h149H56H2(H131516)
MFCD01647537
O=C1NC(=O)C2(S1)COC(OC2)c1cccc(c1)(N+)(=O)(O)
ZINC000000990032
ZINC00990032
ZINC990032
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