Vitas-M small molecule compound
(2S,3R,10bS)-3-(2,2-dimethylpropanoyl)-2-(2,3,4-trimethoxyphenyl)-2,3-dihydropyrrolo[2,1-a]isoquinoline-1,1(10bH)-dicarbonitrile
Catalog ID
STK545899
SMILES N#CC1(C#N)[C@H]([C@@H](N2[C@H]1c1ccccc1C=C2)C(=O)C(C)(C)C)c1ccc(c(c1OC)OC)OC
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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 C28H29N3O4 MW 471.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O4/c1-27(2,3)26(32)22-21(19-11-12-20(33-4)24(35-6)23(19)34-5)28(15-29,16-30)25-18-10-8-7-9-17(18)13-14-31(22)25/h7-14,21-22,25H,1-6H3/t21-,22+,25-/m0/s1InChIKey
JAIOTHSSLPTWPD-FBLLAGFSSA-NSynonyms
956987-79-4(2S3R10bS)3(22dimethylpropanoyl)2(234trimethoxyphenyl)23dihydropyrrolo(21a)isoquinoline11(10bH)dicarbonitrile
(2S3R10BS)3(22DIMETHYLPROPANOYL)2(234TRIMETHOXYPHENYL)310BDIHYDRO2HPYRROLO(21A)ISOQUINOLINE11DICARBONITRILE
(2S3R10bS)3pivaloyl2(234trimethoxyphenyl)23dihydropyrrolo(21a)isoquinoline11(10bH)dicarbonitrile
956987794
CC(C)(C)C(=O)C1C(C(C2N1C=CC3=CC=CC=C23)(C#N)C#N)C4=C(C(=C(C=C4)OC)OC)OC
InChI=1SC28H29N3O4c127(23)26(32)2221(19111220(334)24(356)23(19)345)28(15291630)25181087917(18)131431(22)25h714212225H16H3t2122+25m0s1
N#CC1(C#N)(C@H)((C@@H)(N2(C@H)1c1ccccc1C=C2)C(=O)C(C)(C)C)c1ccc(c(c1OC)OC)OC
ZINC000035494207
ZINC35494207
Check stock
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Check stock on Vitas-MAvailable files
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