Vitas-M small molecule compound

5',7'-dimethyl-2'-(phenylcarbonyl)-1'-(thiophen-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one

Catalog ID
STL347514
SMILES Cc1ccc2c(c1)C(=CC1N2C(C(=O)c2cccs2)C(C21C(=O)Nc1c2cccc1)C(=O)c1ccccc1)C

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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 C33H26N2O3S MW 530.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H26N2O3S/c1-19-14-15-25-22(17-19)20(2)18-27-33(23-11-6-7-12-24(23)34-32(33)38)28(30(36)21-9-4-3-5-10-21)29(35(25)27)31(37)26-13-8-16-39-26/h3-18,27-29H,1-2H3,(H,34,38)
InChIKey
GEVDKQLPVVXEBG-UHFFFAOYSA-N
Synonyms

(1S2S3R3aR)2benzoyl57dimethyl1(thiophene2carbonyl)23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
2benzoyl57dimethyl1(thiophene2carbonyl)spiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
57dimethyl2(phenylcarbonyl)1(thiophen2ylcarbonyl)12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
CC1=CC2=C(C=C1)N3C(C=C2C)C4(C(C3C(=O)C5=CC=CS5)C(=O)C6=CC=CC=C6)C7=CC=CC=C7NC4=O
Cc1ccc2c(c1)C(=C(C@H)1N2(C@H)(C(=O)c2cccs2)(C@H)((C@@)21C(=O)Nc1c2cccc1)C(=O)c1ccccc1)C
InChI=1SC33H26N2O3Sc11914152522(1719)20(2)182733(2311671224(23)3432(33)38)28(30(36)2194351021)29(35(25)27)31(37)26138163926h3182729H12H3(H3438)
MFCD07201314
ZINC000101360737
ZINC000245309772

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Available files

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