Vitas-M small molecule compound
(2E)-3-[3-(3-chloro-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-N-(furan-2-ylmethyl)-2-(phenylsulfonyl)prop-2-enamide
Catalog ID
STK822975
SMILES COc1ccc(cc1Cl)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 C30H24ClN3O5S MW 574.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24ClN3O5S/c1-38-27-15-14-21(17-26(27)31)29-22(20-34(33-29)23-9-4-2-5-10-23)18-28(30(35)32-19-24-11-8-16-39-24)40(36,37)25-12-6-3-7-13-25/h2-18,20H,19H2,1H3,(H,32,35)/b28-18+InChIKey
ALIWFSKQGBOQTJ-MTDXEUNCSA-NSynonyms
(2E)3(3(3chloro4methoxyphenyl)1phenyl1Hpyrazol4yl)N(furan2ylmethyl)2(phenylsulfonyl)prop2enamide
(E)2(benzenesulfonyl)3(3(3chloro4methoxyphenyl)1phenylpyrazol4yl)N(furan2ylmethyl)prop2enamide
COC1=C(C=C(C=C1)C2=NN(C=C2C=C(C(=O)NCC3=CC=CO3)S(=O)(=O)C4=CC=CC=C4)C5=CC=CC=C5)Cl
COc1ccc(cc1Cl)c1nn(cc1C=C(S(=O)(=O)c1ccccc1)C(=O)NCc1ccco1)c1ccccc1
InChI=1SC30H24ClN3O5Sc13827151421(1726(27)31)2922(2034(3329)2394251023)1828(30(35)321924118163924)40(3637)25126371325h21820H19H21H3(H3235)b2818+
MFCD03463537
ZINC000097947122
ZINC97947122
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