Vitas-M small molecule compound
(1S,2S,3aR)-2-(thiophen-2-yl)-1-(thiophen-2-ylcarbonyl)-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Catalog ID
STK525912
SMILES N#CC1(C#N)[C@H](c2cccs2)[C@H](N2[C@@H]1C=Cc1c2cccc1)C(=O)c1cccs1
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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 C23H15N3OS2 MW 413.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15N3OS2/c24-13-23(14-25)19-10-9-15-5-1-2-6-16(15)26(19)21(20(23)17-7-3-11-28-17)22(27)18-8-4-12-29-18/h1-12,19-21H/t19-,20-,21+/m1/s1InChIKey
KCHQYVGDMAWPGB-NJYVYQBISA-NSynonyms
294845-40-2(1S2S3aR)1(thiophene2carbonyl)2thiophen2yl23adihydro1Hpyrrolo(12a)quinoline33dicarbonitrile
(1S2S3aR)2(thiophen2yl)1(thiophen2ylcarbonyl)12dihydropyrrolo(12a)quinoline33(3aH)dicarbonitrile
(1S2S3aR)2(thiophen2yl)1(thiophene2carbonyl)12dihydropyrrolo(12a)quinoline33(3aH)dicarbonitrile
294845402
C1=CC=C2C(=C1)C=CC3N2C(C(C3(C#N)C#N)C4=CC=CS4)C(=O)C5=CC=CS5
InChI=1SC23H15N3OS2c241323(1425)1910915512616(15)26(19)21(20(23)1773112817)22(27)1884122918h1121921Ht192021+m1s1
N#CC1(C#N)(C@H)(c2cccs2)(C@H)(N2(C@@H)1C=Cc1c2cccc1)C(=O)c1cccs1
ZINC000008934628
ZINC08934628
ZINC8934628
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