Vitas-M small molecule compound

methyl 2-({[7-(furan-2-yl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STL405453
SMILES COC(=O)c1c(sc2c1CCCC2)NC(=O)c1cnn2c1nccc2c1ccco1

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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 C21H18N4O4S MW 422.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O4S/c1-28-21(27)17-12-5-2-3-7-16(12)30-20(17)24-19(26)13-11-23-25-14(8-9-22-18(13)25)15-6-4-10-29-15/h4,6,8-11H,2-3,5,7H2,1H3,(H,24,26)
InChIKey
DYZIMXMJGAINSS-UHFFFAOYSA-N
Synonyms
931983-58-3
931983583
COC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=C4N=CC=C(N4N=C3)C5=CC=CO5
InChI=1SC21H18N4O4Sc12821(27)1712523716(12)3020(17)2419(26)1311232514(892218(13)25)1564102915h46811H2357H21H3(H2426)
methyl2(((7(furan2yl)pyrazolo(15a)pyrimidin3yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((7(furan2yl)pyrazolo(15a)pyrimidine3carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD08557955
ZINC000013644562
ZINC13644562

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Available files

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