Vitas-M small molecule compound

2'-(2,4-dimethoxyphenyl)-1'-(thiophen-2-ylcarbonyl)-1',2'-dihydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1,3-dione

Catalog ID
STL234466
SMILES COc1ccc(c(c1)OC)C1C(C(=O)c2cccs2)N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1

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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 C33H25NO5S MW 547.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H25NO5S/c1-38-20-14-15-23(25(18-20)39-2)28-29(30(35)26-12-7-17-40-26)34-24-11-6-3-8-19(24)13-16-27(34)33(28)31(36)21-9-4-5-10-22(21)32(33)37/h3-18,27-29H,1-2H3
InChIKey
OLXBSLOUUUJITP-UHFFFAOYSA-N
Synonyms

(1R2R)2(24dimethoxyphenyl)1(thiophene2carbonyl)23adihydro1Hspiro(indene23pyrrolo(12a)quinoline)13dione
2(24dimethoxyphenyl)1(thiophen2ylcarbonyl)12dihydro3aHspiro(indene23pyrrolo(12a)quinoline)13dione
2(24DIMETHOXYPHENYL)1(THIOPHENE2CARBONYL)SPIRO(23ADIHYDRO1HPYRROLO(12A)QUINOLINE32INDENE)13DIONE
COC1=CC(=C(C=C1)C2C(N3C(C24C(=O)C5=CC=CC=C5C4=O)C=CC6=CC=CC=C63)C(=O)C7=CC=CS7)OC
COc1ccc(c(c1)OC)(C@H)1(C@H)(C(=O)c2cccs2)N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2cccc1
InChI=1SC33H25NO5Sc13820141523(25(1820)392)2829(30(35)26127174026)34241163819(24)131627(34)33(28)31(36)219451022(21)32(33)37h3182729H12H3
MFCD24858448
ZINC000101344361
ZINC000230199968

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Available files

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