Vitas-M small molecule compound
2-(3-hydroxyphenyl)-3-(phenylcarbonyl)-2,3-dihydrobenzo[f]pyrrolo[1,2-a]quinoline-1,1(12aH)-dicarbonitrile
Catalog ID
STL351358
SMILES N#CC1(C#N)C2C=Cc3c(N2C(C1c1cccc(c1)O)C(=O)c1ccccc1)ccc1c3cccc1
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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 C31H21N3O2 MW 467.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H21N3O2/c32-18-31(19-33)27-16-14-25-24-12-5-4-7-20(24)13-15-26(25)34(27)29(30(36)21-8-2-1-3-9-21)28(31)22-10-6-11-23(35)17-22/h1-17,27-29,35HInChIKey
GJPNRQJYXQOAEA-UHFFFAOYSA-NSynonyms
(2S3S12aR)3benzoyl2(3hydroxyphenyl)23dihydrobenzo(f)pyrrolo(12a)quinoline11(12aH)dicarbonitrile
2(3hydroxyphenyl)3(phenylcarbonyl)23dihydrobenzo(f)pyrrolo(12a)quinoline11(12aH)dicarbonitrile
3benzoyl2(3hydroxyphenyl)312adihydro2Hnaphtho(21e)indolizine11dicarbonitrile
C1=CC=C(C=C1)C(=O)C2C(C(C3N2C4=C(C=C3)C5=CC=CC=C5C=C4)(C#N)C#N)C6=CC(=CC=C6)O
InChI=1SC31H21N3O2c321831(1933)27161425241254720(24)131526(25)34(27)29(30(36)218213921)28(31)221061123(35)1722h117272935H
MFCD28032399
N#CC1(C#N)(C@H)2C=Cc3c(N2(C@@H)((C@H)1c1cccc(c1)O)C(=O)c1ccccc1)ccc1c3cccc1
ZINC000012324822
ZINC000230190148
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