Vitas-M small molecule compound
1-[(4-chlorophenyl)carbonyl]-2-(thiophen-3-yl)-1,2-dihydropyrrolo[1,2-a]quinoline-3,3(3aH)-dicarbonitrile
Catalog ID
STL324128
SMILES N#CC1(C#N)C(c2ccsc2)C(N2C1C=Cc1c2cccc1)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 C25H16ClN3OS MW 441.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H16ClN3OS/c26-19-8-5-17(6-9-19)24(30)23-22(18-11-12-31-13-18)25(14-27,15-28)21-10-7-16-3-1-2-4-20(16)29(21)23/h1-13,21-23HInChIKey
ISXHHSLHOQHZBA-UHFFFAOYSA-NSynonyms
(1S2R3aR)1(4chlorobenzoyl)2(thiophen3yl)12dihydropyrrolo(12a)quinoline33(3aH)dicarbonitrile
1((4chlorophenyl)carbonyl)2(thiophen3yl)12dihydropyrrolo(12a)quinoline33(3aH)dicarbonitrile
1(4CHLOROBENZOYL)2THIOPHEN3YL23ADIHYDRO1HPYRROLO(12A)QUINOLINE33DICARBONITRILE
C1=CC=C2C(=C1)C=CC3N2C(C(C3(C#N)C#N)C4=CSC=C4)C(=O)C5=CC=C(C=C5)Cl
InChI=1SC25H16ClN3OSc26198517(6919)24(30)2322(181112311318)25(14271528)2110716312420(16)29(21)23h1132123H
MFCD28032027
N#CC1(C#N)(C@H)(c2ccsc2)(C@H)(N2(C@@H)1C=Cc1c2cccc1)C(=O)c1ccc(cc1)Cl
ZINC000003171633
ZINC000108519744
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