Vitas-M small molecule compound

ethyl 2-{[({2-[2-(3-acetyl-6-methyl-4-oxo-4H-pyran-2-yl)hydrazinyl]-2-oxoethyl}sulfanyl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK687532
SMILES CCOC(=O)c1c(NC(=O)CSCC(=O)NNc2oc(C)cc(=O)c2C(=O)C)sc2c1CCCC2

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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 C23H27N3O7S2 MW 521.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O7S2/c1-4-32-23(31)20-14-7-5-6-8-16(14)35-22(20)24-17(29)10-34-11-18(30)25-26-21-19(13(3)27)15(28)9-12(2)33-21/h9,26H,4-8,10-11H2,1-3H3,(H,24,29)(H,25,30)
InChIKey
HSRJCIZLBFJVCV-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CSCC(=O)NNC3=C(C(=O)C=C(O3)C)C(=O)C
ethyl2((((2(2(3acetyl6methyl4oxo4Hpyran2yl)hydrazinyl)2oxoethyl)sulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((2(2(2(3acetyl6methyl4oxopyran2yl)hydrazinyl)2oxoethyl)sulfanylacetyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC23H27N3O7S2c143223(31)2014756816(14)3522(20)2417(29)10341118(30)25262119(13(3)27)15(28)912(2)3321h926H481011H213H3(H2429)(H2530)
MFCD06619000
ZINC000015022103
ZINC15022103

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Available files

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