Vitas-M small molecule compound

ethyl 2-amino-8'-fluoro-6',7,7-trimethyl-2',5-dioxo-5,5',6,6',7,8-hexahydrodispiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinoline-4',1''-cyclopentane]-3-carboxylate

Catalog ID
STL361439
SMILES CCOC(=O)C1=C(N)OC2=C(C31c1cc(F)cc4c1N(C3=O)C1(CCCC1)CC4C)C(=O)CC(C2)(C)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 C29H33FN2O5 MW 508.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33FN2O5/c1-5-36-25(34)22-24(31)37-20-14-27(3,4)13-19(33)21(20)29(22)18-11-16(30)10-17-15(2)12-28(8-6-7-9-28)32(23(17)18)26(29)35/h10-11,15H,5-9,12-14,31H2,1-4H3
InChIKey
AHRQURGEYIANLS-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(OC2=C(C13C4=C5C(=CC(=C4)F)C(CC6(N5C3=O)CCCC6)C)C(=O)CC(C2)(C)C)N
ethyl2amino8fluoro677trimethyl25dioxo556678hexahydrodispiro(chromene41pyrrolo(321ij)quinoline41cyclopentane)3carboxylate
InChI=1SC29H33FN2O5c153625(34)2224(31)37201427(34)1319(33)21(20)29(22)181116(30)101715(2)1228(867928)32(23(17)18)26(29)35h101115H59121431H214H3
MFCD08087963
ZINC000014162302
ZINC000014162311

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Available files

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