Vitas-M small molecule compound

7'-chloro-2'-{[4-(2-methylpropyl)phenyl]carbonyl}-1'-(thiophen-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one

Catalog ID
STK569349
SMILES CC(Cc1ccc(cc1)C(=O)C1C(C(=O)c2cccs2)N2C(C31C(=O)Nc1c3cccc1)C=Cc1c2ccc(c1)Cl)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 C35H29ClN2O3S MW 593.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H29ClN2O3S/c1-20(2)18-21-9-11-22(12-10-21)32(39)30-31(33(40)28-8-5-17-42-28)38-27-15-14-24(36)19-23(27)13-16-29(38)35(30)25-6-3-4-7-26(25)37-34(35)41/h3-17,19-20,29-31H,18H2,1-2H3,(H,37,41)
InChIKey
GUWOERFYNJKZIU-UHFFFAOYSA-N
Synonyms

(1S2S3R3aR)7chloro2(4isobutylbenzoyl)1(thiophene2carbonyl)23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
7chloro2((4(2methylpropyl)phenyl)carbonyl)1(thiophen2ylcarbonyl)12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
7chloro2(4(2methylpropyl)benzoyl)1(thiophene2carbonyl)spiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
CC(C)CC1=CC=C(C=C1)C(=O)C2C(N3C(C24C5=CC=CC=C5NC4=O)C=CC6=C3C=CC(=C6)Cl)C(=O)C7=CC=CS7
CC(Cc1ccc(cc1)C(=O)(C@@H)1(C@@H)(C(=O)c2cccs2)N2(C@@H)((C@)31C(=O)Nc1c3cccc1)C=Cc1c2ccc(c1)Cl)C
InChI=1SC35H29ClN2O3Sc120(2)182191122(121021)32(39)3031(33(40)2885174228)3827151424(36)1923(27)131629(38)35(30)25634726(25)3734(35)41h31719202931H18H212H3(H3741)
MFCD05736306
ZINC000102191299
ZINC000245325646

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Available files

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