Vitas-M small molecule compound
ethyl (1R,2S,3S)-3-[(4-chlorophenyl)carbamoyl]-1-cyano-2-phenyl-1,2,3,10b-tetrahydropyrrolo[2,1-a]isoquinoline-1-carboxylate
Catalog ID
STK548278
SMILES CCOC(=O)[C@]1(C#N)[C@H](c2ccccc2)[C@H](N2C1c1ccccc1C=C2)C(=O)Nc1ccc(cc1)Cl
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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 C29H24ClN3O3 MW 497.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24ClN3O3/c1-2-36-28(35)29(18-31)24(20-9-4-3-5-10-20)25(27(34)32-22-14-12-21(30)13-15-22)33-17-16-19-8-6-7-11-23(19)26(29)33/h3-17,24-26H,2H2,1H3,(H,32,34)/t24-,25+,26?,29-/m1/s1InChIKey
YURSCSDTKJFHBX-RCPALMFLSA-NSynonyms
1014059-21-2(1R2S3S)ethyl3((4chlorophenyl)carbamoyl)1cyano2phenyl12310btetrahydropyrrolo(21a)isoquinoline1carboxylate
1014059212
CCOC(=O)(C@)1(C#N)(C@H)(c2ccccc2)(C@H)(N2C1c1ccccc1C=C2)C(=O)Nc1ccc(cc1)Cl
CCOC(=O)C1(C(C(N2C1C3=CC=CC=C3C=C2)C(=O)NC4=CC=C(C=C4)Cl)C5=CC=CC=C5)C#N
ethyl(1R2S3S)3((4chlorophenyl)carbamoyl)1cyano2phenyl12310btetrahydropyrrolo(21a)isoquinoline1carboxylate
ethyl(1R2S3S)3((4chlorophenyl)carbamoyl)1cyano2phenyl310bdihydro2Hpyrrolo(21a)isoquinoline1carboxylate
InChI=1SC29H24ClN3O3c123628(35)29(1831)24(2094351020)25(27(34)3222141221(30)131522)331716198671123(19)26(29)33h3172426H2H21H3(H3234)t2425+26?29m1s1
MFCD18242409
ZINC000035369327
ZINC000035369329
Check stock
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Check stock on Vitas-MAvailable files
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