Vitas-M small molecule compound

(1'S,2'S,3R,3a'R)-1'-(2,2-dimethylpropanoyl)-2'-[(4-methoxyphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one

Catalog ID
STK552482
SMILES COc1ccc(cc1)C(=O)[C@@H]1[C@H](N2[C@@H]([C@]31C(=O)Nc1c3cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)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 C32H30N2O4 MW 506.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30N2O4/c1-31(2,3)29(36)27-26(28(35)20-13-16-21(38-4)17-14-20)32(22-10-6-7-11-23(22)33-30(32)37)25-18-15-19-9-5-8-12-24(19)34(25)27/h5-18,25-27H,1-4H3,(H,33,37)/t25-,26+,27+,32-/m1/s1
InChIKey
DZAUPJNSMSKIDR-JVPIYLDOSA-N
Synonyms
1212457-69-6
(1S2S3R3aR)1(22dimethylpropanoyl)2((4methoxyphenyl)carbonyl)12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
(1S2S3R3aR)1(22dimethylpropanoyl)2(4methoxybenzoyl)spiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
(1S2S3R3aR)2(4methoxybenzoyl)1pivaloyl23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
1212457696
CC(C)(C)C(=O)C1C(C2(C3N1C4=CC=CC=C4C=C3)C5=CC=CC=C5NC2=O)C(=O)C6=CC=C(C=C6)OC
COc1ccc(cc1)C(=O)(C@@H)1(C@H)(N2(C@@H)((C@)31C(=O)Nc1c3cccc1)C=Cc1c2cccc1)C(=O)C(C)(C)C
InChI=1SC32H30N2O4c131(23)29(36)2726(28(35)20131621(384)171420)32(2210671123(22)3330(32)37)251815199581224(19)34(25)27h5182527H14H3(H3337)t2526+27+32m1s1
MFCD18242653
ZINC000009088180
ZINC09088180
ZINC9088180

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Available files

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