Vitas-M small molecule compound

ethyl 6-methyl-2-{[(7-methyl-1-oxo-3,4-dihydro-1H-isochromen-3-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STL021795
SMILES CCOC(=O)c1c(NC(=O)C2OC(=O)c3c(C2)ccc(c3)C)sc2c1CCC(C2)C

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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 C23H25NO5S MW 427.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25NO5S/c1-4-28-23(27)19-15-8-6-13(3)10-18(15)30-21(19)24-20(25)17-11-14-7-5-12(2)9-16(14)22(26)29-17/h5,7,9,13,17H,4,6,8,10-11H2,1-3H3,(H,24,25)
InChIKey
CGFKVIJEIRRQCF-UHFFFAOYSA-N
Synonyms
853890-38-7
853890387
CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C3CC4=C(C=C(C=C4)C)C(=O)O3
ethyl6methyl2(((7methyl1oxo34dihydro1Hisochromen3yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl6methyl2((7methyl1oxo34dihydroisochromene3carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC23H25NO5Sc142823(27)19158613(3)1018(15)3021(19)2420(25)1711147512(2)916(14)22(26)2917h5791317H4681011H213H3(H2425)
MFCD06438618
ZINC000008951725
ZINC000008951728

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Available files

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