Vitas-M small molecule compound

(1S,2S,3aR)-7-chloro-1-[(4-chlorophenyl)carbonyl]-2-phenyl-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile

Catalog ID
STK754120
SMILES N#CC1(C#N)[C@H](c2ccccc2)[C@H](N2[C@@H]1C=Cc1c2ccc(c1)Cl)C(=O)c1ccc(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 C27H17Cl2N3O MW 470.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H17Cl2N3O/c28-20-9-6-18(7-10-20)26(33)25-24(17-4-2-1-3-5-17)27(15-30,16-31)23-13-8-19-14-21(29)11-12-22(19)32(23)25/h1-14,23-25H/t23-,24-,25+/m1/s1
InChIKey
PHEWBTCOERWVJL-SDHSZQHLSA-N
Synonyms
293728-72-0
(1S2S3aR)7chloro1((4chlorophenyl)carbonyl)2phenyl12dihydropyrrolo(12a)quinoline33(3aH)dicarbonitrile
(1S2S3aR)7chloro1(4chlorobenzoyl)2phenyl12dihydropyrrolo(12a)quinoline33(3aH)dicarbonitrile
(1S2S3AR)7CHLORO1(4CHLOROBENZOYL)2PHENYL23ADIHYDRO1HPYRROLO(12A)QUINOLINE33DICARBONITRILE
293728720
C1=CC=C(C=C1)C2C(N3C(C2(C#N)C#N)C=CC4=C3C=CC(=C4)Cl)C(=O)C5=CC=C(C=C5)Cl
InChI=1SC27H17Cl2N3Oc28209618(71020)26(33)2524(174213517)27(15301631)23138191421(29)111222(19)32(23)25h1142325Ht232425+m1s1
MFCD13372060
N#CC1(C#N)(C@H)(c2ccccc2)(C@H)(N2(C@@H)1C=Cc1c2ccc(c1)Cl)C(=O)c1ccc(cc1)Cl
ZINC000003661933
ZINC03661933
ZINC3661933

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Available files

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