Vitas-M small molecule compound
(1'R,2'S,3R)-1'-acetyl-7'-chloro-2'-[(4-pentylphenyl)carbonyl]-1',2'-dihydro-3a'H-spiro[indole-3,3'-pyrrolo[1,2-a]quinolin]-2(1H)-one
Catalog ID
STK544118
SMILES CCCCCc1ccc(cc1)C(=O)[C@@H]1[C@H](C(=O)C)N2C([C@]31C(=O)Nc1c3cccc1)C=Cc1c2ccc(c1)Cl
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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 C33H31ClN2O3 MW 539.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H31ClN2O3/c1-3-4-5-8-21-11-13-22(14-12-21)31(38)29-30(20(2)37)36-27-17-16-24(34)19-23(27)15-18-28(36)33(29)25-9-6-7-10-26(25)35-32(33)39/h6-7,9-19,28-30H,3-5,8H2,1-2H3,(H,35,39)/t28?,29-,30-,33+/m0/s1InChIKey
OWOQNXIYDYCWDZ-DPPJQHQISA-NSynonyms
1177818-17-5(1R2S3R)1acetyl7chloro2((4pentylphenyl)carbonyl)12dihydro3aHspiro(indole33pyrrolo(12a)quinolin)2(1H)one
(1R2S3R)1acetyl7chloro2(4pentylbenzoyl)23adihydro1Hspiro(indoline33pyrrolo(12a)quinolin)2one
(1R2S3R)1acetyl7chloro2(4pentylbenzoyl)spiro(1Hindole3323adihydro1Hpyrrolo(12a)quinoline)2one
1177818175
CCCCCC1=CC=C(C=C1)C(=O)C2C(N3C(C24C5=CC=CC=C5NC4=O)C=CC6=C3C=CC(=C6)Cl)C(=O)C
CCCCCc1ccc(cc1)C(=O)(C@@H)1(C@H)(C(=O)C)N2C((C@)31C(=O)Nc1c3cccc1)C=Cc1c2ccc(c1)Cl
InChI=1SC33H31ClN2O3c1345821111322(141221)31(38)2930(20(2)37)3627171624(34)1923(27)151828(36)33(29)259671026(25)3532(33)39h679192830H358H212H3(H3539)t28?293033+m0s1
MFCD18242128
ZINC000100846726
ZINC000100846728
Check stock
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Check stock on Vitas-MAvailable files
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