Vitas-M small molecule compound

(1'S,2'S,3R,3a'R)-1'-(phenylcarbonyl)-2'-(pyridin-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one

Catalog ID
STK553751
SMILES O=C([C@H]1N2c3ccccc3C=C[C@@H]2[C@]2([C@@H]1C(=O)c1ccccn1)C(=O)Nc1c2cccc1)c1ccccc1

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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 C32H23N3O3 MW 497.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H23N3O3/c36-29(21-11-2-1-3-12-21)28-27(30(37)24-15-8-9-19-33-24)32(22-13-5-6-14-23(22)34-31(32)38)26-18-17-20-10-4-7-16-25(20)35(26)28/h1-19,26-28H,(H,34,38)/t26-,27+,28+,32-/m1/s1
InChIKey
NHAQAWKNVZFSDC-QODLHPCFSA-N
Synonyms
1212470-45-5
(1S2S3R3aR)1(phenylcarbonyl)2(pyridin2ylcarbonyl)12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
(1S2S3R3aR)1benzoyl2(pyridine2carbonyl)spiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
(1S2S3R3aR)1benzoyl2picolinoyl23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
1212470455
C1=CC=C(C=C1)C(=O)C2C(C3(C4N2C5=CC=CC=C5C=C4)C6=CC=CC=C6NC3=O)C(=O)C7=CC=CC=N7
InChI=1SC32H23N3O3c3629(21112131221)2827(30(37)241589193324)32(2213561423(22)3431(32)38)2618172010471625(20)35(26)28h1192628H(H3438)t2627+28+32m1s1
MFCD18242741
O=C((C@H)1N2c3ccccc3C=C(C@@H)2(C@)2((C@@H)1C(=O)c1ccccn1)C(=O)Nc1c2cccc1)c1ccccc1
ZINC000009111565
ZINC09111565
ZINC9111565

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.