Vitas-M small molecule compound

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

Catalog ID
STK748717
SMILES N#CC1(C#N)[C@H](c2ccccc2)[C@H](N2[C@@H]1C=Cc1c2ccc(c1)Cl)C(=O)c1ccc(cc1)C

Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.

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 C28H20ClN3O MW 449.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20ClN3O/c1-18-7-9-20(10-8-18)27(33)26-25(19-5-3-2-4-6-19)28(16-30,17-31)24-14-11-21-15-22(29)12-13-23(21)32(24)26/h2-15,24-26H,1H3/t24-,25-,26+/m1/s1
InChIKey
NPTFPJMIBFTQJX-CYXNTTPDSA-N
Synonyms

(1S2S3AR)7CHLORO1((4METHYLPHENYL)CARBONYL)2PHENYL12DIHYDROPYRROLO(12A)QUINOLINE33(3AH)DICARBONITRILE
(1S2S3AR)7CHLORO1(4METHYLBENZOYL)2PHENYL23ADIHYDRO1HPYRROLO(12A)QUINOLINE33DICARBONITRILE
CC1=CC=C(C=C1)C(=O)C2C(C(C3N2C4=C(C=C3)C=C(C=C4)Cl)(C#N)C#N)C5=CC=CC=C5
InChI=1SC28H20ClN3Oc1187920(10818)27(33)2625(195324619)28(16301731)241411211522(29)121323(21)32(24)26h2152426H1H3t242526+m1s1
MFCD13372019
N#CC1(C#N)(C@H)(c2ccccc2)(C@H)(N2(C@@H)1C=Cc1c2ccc(c1)Cl)C(=O)c1ccc(cc1)C
ZINC000009761135
ZINC09761135
ZINC9761135

Check stock

See real-time availability and sample size for STK748717 on the Vitas-M platform.

Check stock on Vitas-M

Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.