Vitas-M small molecule compound

1'-[(3-methoxyphenyl)carbonyl]-5'-methyl-2'-(pyridin-4-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one

Catalog ID
STL348458
SMILES COc1cccc(c1)C(=O)C1N2c3ccccc3C(=CC2C2(C1C(=O)c1ccncc1)C(=O)Nc1c2cccc1)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 C34H27N3O4 MW 541.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H27N3O4/c1-20-18-28-34(25-11-4-5-12-26(25)36-33(34)40)29(31(38)21-14-16-35-17-15-21)30(37(28)27-13-6-3-10-24(20)27)32(39)22-8-7-9-23(19-22)41-2/h3-19,28-30H,1-2H3,(H,36,40)
InChIKey
KSEFCHOPRDBGJY-UHFFFAOYSA-N
Synonyms

(1S2S3R3aR)2isonicotinoyl1(3methoxybenzoyl)5methyl23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
1((3methoxyphenyl)carbonyl)5methyl2(pyridin4ylcarbonyl)12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
1(3methoxybenzoyl)5methyl2(pyridine4carbonyl)spiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
CC1=CC2C3(C(C(N2C4=CC=CC=C14)C(=O)C5=CC(=CC=C5)OC)C(=O)C6=CC=NC=C6)C7=CC=CC=C7NC3=O
COc1cccc(c1)C(=O)(C@H)1N2c3ccccc3C(=C(C@@H)2(C@)2((C@@H)1C(=O)c1ccncc1)C(=O)Nc1c2cccc1)C
InChI=1SC34H27N3O4c120182834(2511451226(25)3633(34)40)29(31(38)21141635171521)30(37(28)2713631024(20)27)32(39)2287923(1922)412h3192830H12H3(H3640)
MFCD07202187
ZINC000226856889
ZINC000245310797

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Available files

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