Vitas-M small molecule compound

(2Z)-2-cyano-N-(1,1-dioxidotetrahydrothiophen-3-yl)-3-[3-(3-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]prop-2-enamide

Catalog ID
STK706810
SMILES N#C/C(=C/c1cn(nc1c1cccc(c1)OC)c1ccccc1)/C(=O)NC1CCS(=O)(=O)C1

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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 C24H22N4O4S MW 462.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O4S/c1-32-22-9-5-6-17(13-22)23-19(15-28(27-23)21-7-3-2-4-8-21)12-18(14-25)24(29)26-20-10-11-33(30,31)16-20/h2-9,12-13,15,20H,10-11,16H2,1H3,(H,26,29)/b18-12-
InChIKey
DHSTWPFQIOMFSB-PDGQHHTCSA-N
Synonyms
1008883-92-8
(2Z)2cyanoN(11dioxidotetrahydrothiophen3yl)3(3(3methoxyphenyl)1phenyl1Hpyrazol4yl)prop2enamide
(Z)2cyanoN(11dioxidotetrahydrothiophen3yl)3(3(3methoxyphenyl)1phenyl1Hpyrazol4yl)acrylamide
(Z)2cyanoN(11dioxothiolan3yl)3(3(3methoxyphenyl)1phenylpyrazol4yl)prop2enamide
1008883928
COC1=CC=CC(=C1)C2=NN(C=C2C=C(C#N)C(=O)NC3CCS(=O)(=O)C3)C4=CC=CC=C4
InChI=1SC24H22N4O4Sc1322295617(1322)2319(1528(2723)217324821)1218(1425)24(29)2620101133(3031)1620h2912131520H101116H21H3(H2629)b1812
MFCD04022526
N#CC(=Cc1cn(nc1c1cccc(c1)OC)c1ccccc1)C(=O)NC1CCS(=O)(=O)C1
ZINC000009424237
ZINC000013748568

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Available files

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