Vitas-M small molecule compound
ethyl 10-methoxy-2-methyl-4-thioxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-11-carboxylate
Catalog ID
STL092825
SMILES CCOC(=O)C1C2NC(=S)NC1(C)Oc1c2cccc1OC
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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 C15H18N2O4S MW 322.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N2O4S/c1-4-20-13(18)10-11-8-6-5-7-9(19-3)12(8)21-15(10,2)17-14(22)16-11/h5-7,10-11H,4H2,1-3H3,(H2,16,17,22)InChIKey
ZZEJARMIQWCWFO-UHFFFAOYSA-NSynonyms
1022789-35-01022789350
CCOC(=O)C1C2C3=C(C(=CC=C3)OC)OC1(NC(=S)N2)C
ethyl10methoxy2methyl4thioxo3456tetrahydro2H26methano135benzoxadiazocine11carboxylate
InChI=1SC15H18N2O4Sc142013(18)101186579(193)12(8)2115(102)1714(22)1611h571011H4H213H3(H2161722)
MFCD15085826
ZINC000100029507
ZINC000100029510
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