Vitas-M small molecule compound

ethyl (1'S,2'S)-2'-(furan-2-yl)-1,3-dioxo-1,1',2',3-tetrahydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinoline]-1'-carboxylate

Catalog ID
STK557150
SMILES CCOC(=O)[C@H]1N2c3ccccc3C=CC2[C@@]2([C@@H]1c1ccco1)C(=O)c1c(C2=O)cccc1

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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 C27H21NO5 MW 439.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21NO5/c1-2-32-26(31)23-22(20-12-7-15-33-20)27(24(29)17-9-4-5-10-18(17)25(27)30)21-14-13-16-8-3-6-11-19(16)28(21)23/h3-15,21-23H,2H2,1H3/t21?,22-,23+/m1/s1
InChIKey
QFWYLEYRXUFTBP-NRSZHQCHSA-N
Synonyms
1216944-70-5
(1S2S)ethyl2(furan2yl)13dioxo1233atetrahydro1Hspiro(indene23pyrrolo(12a)quinoline)1carboxylate
1216944705
CCOC(=O)(C@H)1N2c3ccccc3C=CC2(C@@)2((C@@H)1c1ccco1)C(=O)c1c(C2=O)cccc1
CCOC(=O)(C@H)1N2c3ccccc3C=CC2C2((C@@H)1c1ccco1)C(=O)c1c(C2=O)cccc1
CCOC(=O)C1C(C2(C3N1C4=CC=CC=C4C=C3)C(=O)C5=CC=CC=C5C2=O)C6=CC=CO6
ethyl(1S2S)2(furan2yl)13dioxo1123tetrahydro3aHspiro(indene23pyrrolo(12a)quinoline)1carboxylate
ethyl(1S2S)2(furan2yl)13dioxospiro(23adihydro1Hpyrrolo(12a)quinoline32indene)1carboxylate
InChI=1SC27H21NO5c123226(31)2322(20127153320)27(24(29)179451018(17)25(27)30)211413168361119(16)28(21)23h3152123H2H21H3t21?2223+m1s1
ZINC000009424294
ZINC000009425276

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Available files

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