Vitas-M small molecule compound
(8S,8aR,11aS)-10-(3-chlorophenyl)-N-(4-chlorophenyl)-9,11-dioxo-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxamide
Catalog ID
STK547764
SMILES Clc1ccc(cc1)NC(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc(c1)Cl)cccc3
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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 C27H19Cl2N3O3 MW 504.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19Cl2N3O3/c28-16-8-10-18(11-9-16)30-25(33)24-22-21(23-20-7-2-1-4-15(20)12-13-31(23)24)26(34)32(27(22)35)19-6-3-5-17(29)14-19/h1-14,21-24H,(H,30,33)/t21-,22+,23?,24-/m0/s1InChIKey
QQSMWQXCJPULCO-UZLDWMDBSA-NSynonyms
1014082-61-1(8S8aR11aS)10(3chlorophenyl)N(4chlorophenyl)911dioxo8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carboxamide
1014082611
C1=CC=C2C3C4C(C(N3C=CC2=C1)C(=O)NC5=CC=C(C=C5)Cl)C(=O)N(C4=O)C6=CC(=CC=C6)Cl
Clc1ccc(cc1)NC(=O)(C@H)1N2C=Cc3c(C2(C@@H)2(C@H)1C(=O)N(C2=O)c1cccc(c1)Cl)cccc3
InChI=1SC27H19Cl2N3O3c281681018(11916)3025(33)242221(2320721415(20)121331(23)24)26(34)32(27(22)35)1963517(29)1419h1142124H(H3033)t2122+23?24m0s1
MFCD18242369
ZINC000016037890
ZINC000043716822
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