Vitas-M small molecule compound
(2E)-2-cyano-N-(furan-2-ylmethyl)-3-{1-[4-(4-methoxyphenoxy)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl}prop-2-enamide
Catalog ID
STK988382
SMILES COc1ccc(cc1)Oc1ccc(cc1)n1c(C)cc(c1C)/C=C(/C(=O)NCc1ccco1)\C#N
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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 C28H25N3O4 MW 467.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O4/c1-19-15-21(16-22(17-29)28(32)30-18-27-5-4-14-34-27)20(2)31(19)23-6-8-25(9-7-23)35-26-12-10-24(33-3)11-13-26/h4-16H,18H2,1-3H3,(H,30,32)/b22-16+InChIKey
SBAFRHVSWVXUSP-CJLVFECKSA-NSynonyms
340272-54-0(2E)2cyanoN(furan2ylmethyl)3(1(4(4methoxyphenoxy)phenyl)25dimethyl1Hpyrrol3yl)prop2enamide
(E)2cyanoN(furan2ylmethyl)3(1(4(4methoxyphenoxy)phenyl)25dimethyl1Hpyrrol3yl)acrylamide
(E)2CYANON(FURAN2YLMETHYL)3(1(4(4METHOXYPHENOXY)PHENYL)25DIMETHYLPYRROL3YL)PROP2ENAMIDE
340272540
CC1=CC(=C(N1C2=CC=C(C=C2)OC3=CC=C(C=C3)OC)C)C=C(C#N)C(=O)NCC4=CC=CO4
COc1ccc(cc1)Oc1ccc(cc1)n1c(C)cc(c1C)C=C(C(=O)NCc1ccco1)C#N
InChI=1SC28H25N3O4c1191521(1622(1729)28(32)30182754143427)20(2)31(19)236825(9723)3526121024(333)111326h416H18H213H3(H3032)b2216+
MFCD02195361
ZINC000002314199
ZINC02314199
ZINC2314199
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