Vitas-M small molecule compound

2-amino-3-cyano-4',4',6',7,7-pentamethyl-2',5-dioxo-5,6,7,8-tetrahydro-4'H-spiro[chromene-4,1'-pyrrolo[3,2,1-ij]quinolin]-8'-yl 2-methoxybenzoate

Catalog ID
STK203036
SMILES N#CC1=C(N)OC2=C(C31c1cc(cc4c1N(C3=O)C(C)(C)C=C4C)OC(=O)c1ccccc1OC)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 C33H31N3O6 MW 565.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H31N3O6/c1-17-13-32(4,5)36-27-20(17)11-18(41-29(38)19-9-7-8-10-24(19)40-6)12-21(27)33(30(36)39)22(16-34)28(35)42-25-15-31(2,3)14-23(37)26(25)33/h7-13H,14-15,35H2,1-6H3
InChIKey
DMSMSTUJNJHWBY-UHFFFAOYSA-N
Synonyms

2amino3cyano44677pentamethyl25dioxo5678tetrahydro4Hspiro(chromene41pyrrolo(321ij)quinolin)8yl2methoxybenzoate
CC1=CC(N2C3=C(C=C(C=C13)OC(=O)C4=CC=CC=C4OC)C5(C2=O)C(=C(OC6=C5C(=O)CC(C6)(C)C)N)C#N)(C)C
InChI=1SC33H31N3O6c1171332(45)362720(17)1118(4129(38)199781024(19)406)1221(27)33(30(36)39)22(1634)28(35)42251531(23)1423(37)26(25)33h713H141535H216H3
MFCD06002939
ZINC000001079798
ZINC000001079799

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Available files

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