Vitas-M small molecule compound
(8S,8aR,11aS)-10-(3-chlorophenyl)-9,11-dioxo-N-[3-(trifluoromethyl)phenyl]-8a,9,10,11,11a,11b-hexahydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-8-carboxamide
Catalog ID
STK574937
SMILES Clc1cccc(c1)N1C(=O)[C@@H]2[C@H](C1=O)C1N([C@@H]2C(=O)Nc2cccc(c2)C(F)(F)F)C=Cc2c1cccc2
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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 C28H19ClF3N3O3 MW 537.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H19ClF3N3O3/c29-17-7-4-9-19(14-17)35-26(37)21-22(27(35)38)24(34-12-11-15-5-1-2-10-20(15)23(21)34)25(36)33-18-8-3-6-16(13-18)28(30,31)32/h1-14,21-24H,(H,33,36)/t21-,22+,23?,24-/m0/s1InChIKey
VLGFCPJTZUAQFW-UZLDWMDBSA-NSynonyms
1013871-05-0(8S8aR11aS)10(3chlorophenyl)911dioxoN(3(trifluoromethyl)phenyl)8a9101111a11bhexahydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline8carboxamide
1013871050
C1=CC=C2C3C4C(C(N3C=CC2=C1)C(=O)NC5=CC=CC(=C5)C(F)(F)F)C(=O)N(C4=O)C6=CC(=CC=C6)Cl
Clc1cccc(c1)N1C(=O)(C@@H)2(C@H)(C1=O)C1N((C@@H)2C(=O)Nc2cccc(c2)C(F)(F)F)C=Cc2c1cccc2
InChI=1SC28H19ClF3N3O3c291774919(1417)3526(37)2122(27(35)38)24(341211155121020(15)23(21)34)25(36)331883616(1318)28(3031)32h1142124H(H3336)t2122+23?24m0s1
MFCD18245517
ZINC000101153476
ZINC000101153478
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