Vitas-M small molecule compound
ethyl 2-{[(4-oxo-1-phenyl-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL405447
SMILES CCOC(=O)c1c(NC(=O)Cn2cnc3c(c2=O)cnn3c2ccccc2)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 C24H23N5O4S MW 477.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N5O4S/c1-2-33-24(32)20-16-10-6-7-11-18(16)34-22(20)27-19(30)13-28-14-25-21-17(23(28)31)12-26-29(21)15-8-4-3-5-9-15/h3-5,8-9,12,14H,2,6-7,10-11,13H2,1H3,(H,27,30)InChIKey
GNOICKPGDRSLAM-UHFFFAOYSA-NSynonyms
938007-10-4938007104
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CN3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5
ethyl2(((4oxo1phenyl14dihydro5Hpyrazolo(34d)pyrimidin5yl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((2(4oxo1phenylpyrazolo(34d)pyrimidin5yl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC24H23N5O4Sc123324(32)201610671118(16)3422(20)2719(30)132814252117(23(28)31)122629(21)158435915h35891214H267101113H21H3(H2730)
MFCD08558710
ZINC000020607335
ZINC20607335
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