Vitas-M small molecule compound
1,1-dicyano-2-(3,4-dimethoxyphenyl)-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinoline-3-carboxamide
Catalog ID
STL259819
SMILES N#CC1(C#N)C(c2ccc(c(c2)OC)OC)C(N2C1c1ccccc1C=C2)C(=O)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 C23H20N4O3 MW 400.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O3/c1-29-17-8-7-15(11-18(17)30-2)19-20(22(26)28)27-10-9-14-5-3-4-6-16(14)21(27)23(19,12-24)13-25/h3-11,19-21H,1-2H3,(H2,26,28)InChIKey
PIHDTVDPNVAXPG-UHFFFAOYSA-NSynonyms
(2S3S)11dicyano2(34dimethoxyphenyl)12310btetrahydropyrrolo(21a)isoquinoline3carboxamide
11dicyano2(34dimethoxyphenyl)12310btetrahydropyrrolo(21a)isoquinoline3carboxamide
11DICYANO2(34DIMETHOXYPHENYL)310BDIHYDRO2HPYRROLO(21A)ISOQUINOLINE3CARBOXAMIDE
COC1=C(C=C(C=C1)C2C(N3C=CC4=CC=CC=C4C3C2(C#N)C#N)C(=O)N)OC
InChI=1SC23H20N4O3c129178715(1118(17)302)1920(22(26)28)2710914534616(14)21(27)23(191224)1325h3111921H12H3(H22628)
MFCD07198681
N#CC1(C#N)(C@H)(c2ccc(c(c2)OC)OC)(C@H)(N2C1c1ccccc1C=C2)C(=O)N
ZINC000035369365
ZINC000245311635
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