Vitas-M small molecule compound
methyl 10-methoxy-3-(2-methoxyethyl)-2-methyl-4-thioxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-11-carboxylate
Catalog ID
STL134503
SMILES COCCN1C(=S)NC2C(C1(C)Oc1c2cccc1OC)C(=O)OC
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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 C17H22N2O5S MW 366.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2O5S/c1-17-12(15(20)23-4)13(18-16(25)19(17)8-9-21-2)10-6-5-7-11(22-3)14(10)24-17/h5-7,12-13H,8-9H2,1-4H3,(H,18,25)InChIKey
IDYKQZRASYVKHL-UHFFFAOYSA-NSynonyms
CC12C(C(C3=C(O1)C(=CC=C3)OC)NC(=S)N2CCOC)C(=O)OC
InChI=1SC17H22N2O5Sc11712(15(20)234)13(1816(25)19(17)89212)1065711(223)14(10)2417h571213H89H214H3(H1825)
methyl10methoxy3(2methoxyethyl)2methyl4thioxo3456tetrahydro2H26methano135benzoxadiazocine11carboxylate
MFCD14746274
ZINC000169700667
ZINC000245257923
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