Vitas-M small molecule compound
(1S,2S,3aR)-7-chloro-2-(3-iodophenyl)-1-(phenylcarbonyl)-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Catalog ID
STK667995
SMILES N#CC1(C#N)[C@H]2C=Cc3c(N2[C@@H]([C@H]1c1cccc(c1)I)C(=O)c1ccccc1)ccc(c3)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 C27H17ClIN3O MW 561.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H17ClIN3O/c28-20-10-11-22-18(13-20)9-12-23-27(15-30,16-31)24(19-7-4-8-21(29)14-19)25(32(22)23)26(33)17-5-2-1-3-6-17/h1-14,23-25H/t23-,24-,25+/m1/s1InChIKey
ICQJPDHSYAWLAF-SDHSZQHLSA-NSynonyms
(1S2S3AR)1BENZOYL7CHLORO2(3IODOPHENYL)23ADIHYDRO1HPYRROLO(12A)QUINOLINE33DICARBONITRILE
(1S2S3aR)7chloro2(3iodophenyl)1(phenylcarbonyl)12dihydropyrrolo(12a)quinoline33(3aH)dicarbonitrile
1BENZOYL7CHLORO2(3IODOPHENYL)12DIHYDROPYRROLO(12A)QUINOLINE33(3AH)DICARBONITRILE
C1=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)I
InChI=1SC27H17ClIN3Oc282010112218(1320)9122327(15301631)24(1974821(29)1419)25(32(22)23)26(33)175213617h1142325Ht232425+m1s1
MFCD01244619
N#CC1(C#N)(C@H)2C=Cc3c(N2(C@@H)((C@H)1c1cccc(c1)I)C(=O)c1ccccc1)ccc(c3)Cl
ZINC000008427341
ZINC08427341
ZINC8427341
Check stock
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