Vitas-M small molecule compound

4-[7-hydroxy-3-methyl-4-(1-methyl-1H-pyrazol-4-yl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-1-yl]benzoic acid

Catalog ID
STL250309
SMILES OC1=Nc2c(C(SC1)c1cnn(c1)C)c(nn2c1ccc(cc1)C(=O)O)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 C18H17N5O3S MW 383.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N5O3S/c1-10-15-16(12-7-19-22(2)8-12)27-9-14(24)20-17(15)23(21-10)13-5-3-11(4-6-13)18(25)26/h3-8,16H,9H2,1-2H3,(H,20,24)(H,25,26)
InChIKey
USGTZPVOTHOVJZ-UHFFFAOYSA-N
Synonyms
1401601-57-7
1401601577
4(7hydroxy3methyl4(1methyl1Hpyrazol4yl)46dihydro1Hpyrazolo(34e)(14)thiazepin1yl)benzoicacid
MFCD24852306
ZINC000079483222
ZINC000079483225

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Available files

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