Vitas-M small molecule compound

prop-2-en-1-yl 10-methoxy-3-(2-methoxyphenyl)-2-methyl-4-thioxo-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-11-carboxylate

Catalog ID
STL092801
SMILES C=CCOC(=O)C1C2NC(=S)N(C1(C)Oc1c2cccc1OC)c1ccccc1OC

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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 C23H24N2O5S MW 440.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N2O5S/c1-5-13-29-21(26)18-19-14-9-8-12-17(28-4)20(14)30-23(18,2)25(22(31)24-19)15-10-6-7-11-16(15)27-3/h5-12,18-19H,1,13H2,2-4H3,(H,24,31)
InChIKey
JYUDWJJOUAVIDZ-UHFFFAOYSA-N
Synonyms
1005087-77-3
1005087773
CC12C(C(C3=C(O1)C(=CC=C3)OC)NC(=S)N2C4=CC=CC=C4OC)C(=O)OCC=C
InChI=1SC23H24N2O5Sc15132921(26)181914981217(284)20(14)3023(182)25(22(31)2419)1510671116(15)273h5121819H113H224H3(H2431)
MFCD15086162
prop2en1yl10methoxy3(2methoxyphenyl)2methyl4thioxo3456tetrahydro2H26methano135benzoxadiazocine11carboxylate
ZINC000104787110
ZINC000104787113

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Available files

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