Vitas-M small molecule compound

(1'S,2'S,3R,3a'R)-1'-(2,2-dimethylpropanoyl)-7'-methyl-2'-(phenylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one

Catalog ID
STK589313
SMILES Cc1ccc2c(c1)C=C[C@H]1N2[C@H](C(=O)C(C)(C)C)[C@H]([C@@]21C(=O)Nc1c2cccc1)C(=O)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 C32H30N2O3 MW 490.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30N2O3/c1-19-14-16-24-21(18-19)15-17-25-32(22-12-8-9-13-23(22)33-30(32)37)26(28(35)20-10-6-5-7-11-20)27(34(24)25)29(36)31(2,3)4/h5-18,25-27H,1-4H3,(H,33,37)/t25-,26+,27+,32-/m1/s1
InChIKey
FQNBKLAYQNMRSZ-JVPIYLDOSA-N
Synonyms
1177923-29-3
(1S2S3R3aR)1(22dimethylpropanoyl)7methyl2(phenylcarbonyl)12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
(1S2S3R3aR)2benzoyl1(22dimethylpropanoyl)7methylspiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
(1S2S3R3aR)2benzoyl7methyl1pivaloyl23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
1177923293
CC1=CC2=C(C=C1)N3C(C=C2)C4(C(C3C(=O)C(C)(C)C)C(=O)C5=CC=CC=C5)C6=CC=CC=C6NC4=O
Cc1ccc2c(c1)C=C(C@H)1N2(C@H)(C(=O)C(C)(C)C)(C@H)((C@@)21C(=O)Nc1c2cccc1)C(=O)c1ccccc1
InChI=1SC32H30N2O3c11914162421(1819)15172532(2212891323(22)3330(32)37)26(28(35)20106571120)27(34(24)25)29(36)31(23)4h5182527H14H3(H3337)t2526+27+32m1s1
MFCD18245851
ZINC000009209416
ZINC09209416
ZINC9209416

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Available files

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