Vitas-M small molecule compound
(2'S,3S,3'S,10b'R)-2'-[(2,5-dimethoxyphenyl)carbonyl]-3'-(thiophen-2-ylcarbonyl)-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Catalog ID
STK578056
SMILES COc1ccc(c(c1)C(=O)[C@@H]1[C@@H](C(=O)c2cccs2)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2)OC
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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 C33H26N2O5S MW 562.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H26N2O5S/c1-39-20-13-14-25(40-2)22(18-20)29(36)27-28(30(37)26-12-7-17-41-26)35-16-15-19-8-3-4-9-21(19)31(35)33(27)23-10-5-6-11-24(23)34-32(33)38/h3-18,27-28,31H,1-2H3,(H,34,38)/t27-,28-,31+,33+/m0/s1InChIKey
GXDQUHIFXPEZMT-TVNXZVQQSA-NSynonyms
1212160-89-8(1S2S3S10bR)2(25dimethoxybenzoyl)3(thiophene2carbonyl)310bdihydro2Hspiro(indoline31pyrrolo(21a)isoquinolin)2one
(2S3S3S10bR)2((25dimethoxyphenyl)carbonyl)3(thiophen2ylcarbonyl)23dihydro10bHspiro(indole31pyrrolo(21a)isoquinolin)2(1H)one
(2S3S3S10bR)2(25dimethoxybenzoyl)3(thiophene2carbonyl)spiro(1Hindole31310bdihydro2Hpyrrolo(21a)isoquinoline)2one
1212160898
COC1=CC(=C(C=C1)OC)C(=O)C2C(N3C=CC4=CC=CC=C4C3C25C6=CC=CC=C6NC5=O)C(=O)C7=CC=CS7
COc1ccc(c(c1)C(=O)(C@@H)1(C@@H)(C(=O)c2cccs2)N2(C@@H)((C@@)31C(=O)Nc1c3cccc1)c1ccccc1C=C2)OC
InChI=1SC33H26N2O5Sc13920131425(402)22(1820)29(36)2728(30(37)26127174126)35161519834921(19)31(35)33(27)2310561124(23)3432(33)38h318272831H12H3(H3438)t272831+33+m0s1
MFCD18158133
ZINC000101670559
ZINC101670559
Check stock
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Check stock on Vitas-MAvailable files
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