Vitas-M small molecule compound

(2E)-N-(furan-2-ylmethyl)-2-(phenylsulfonyl)-3-[1-phenyl-3-(2,4,6-trimethylphenyl)-1H-pyrazol-4-yl]prop-2-enamide

Catalog ID
STK822974
SMILES Cc1cc(C)c(c(c1)C)c1nn(cc1/C=C(/S(=O)(=O)c1ccccc1)\C(=O)NCc1ccco1)c1ccccc1

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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 C32H29N3O4S MW 551.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H29N3O4S/c1-22-17-23(2)30(24(3)18-22)31-25(21-35(34-31)26-11-6-4-7-12-26)19-29(32(36)33-20-27-13-10-16-39-27)40(37,38)28-14-8-5-9-15-28/h4-19,21H,20H2,1-3H3,(H,33,36)/b29-19+
InChIKey
VKFIIIOYLFYBNJ-VUTHCHCSSA-N
Synonyms
(2E)2(BENZENESULFONYL)N(FURAN2YLMETHYL)3(1PHENYL3(246TRIMETHYLPHENYL)1HPYRAZOL4YL)PROP2ENAMIDE
(2E)N(furan2ylmethyl)2(phenylsulfonyl)3(1phenyl3(246trimethylphenyl)1Hpyrazol4yl)prop2enamide
(E)2(benzenesulfonyl)N(furan2ylmethyl)3(1phenyl3(246trimethylphenyl)pyrazol4yl)prop2enamide
CC1=CC(=C(C(=C1)C)C2=NN(C=C2C=C(C(=O)NCC3=CC=CO3)S(=O)(=O)C4=CC=CC=C4)C5=CC=CC=C5)C
Cc1cc(C)c(c(c1)C)c1nn(cc1C=C(S(=O)(=O)c1ccccc1)C(=O)NCc1ccco1)c1ccccc1
Registry IDs
MFCD03463536
ZINC000097947121
ZINC97947121

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Available files

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