Vitas-M small molecule compound

7-chloro-6'-hydroxy-4,6-dimethoxy-1',3',8'-trimethyl-5'-[4-(trifluoromethoxy)phenyl]-1',5',8',9'-tetrahydro-2'H,3H-spiro[1-benzofuran-2,7'-pyrimido[4,5-b]quinoline]-2',3,4'(3'H)-trione

Catalog ID
STL550057
SMILES COc1cc(OC)c(c2c1C(=O)C1(O2)C(C)CC2=Nc3c(C(C2=C1O)c1ccc(cc1)OC(F)(F)F)c(=O)n(c(=O)n3C)C)Cl

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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 C30H25ClF3N3O8 MW 647.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25ClF3N3O8/c1-12-10-15-19(24(38)29(12)25(39)20-16(42-4)11-17(43-5)22(31)23(20)45-29)18(13-6-8-14(9-7-13)44-30(32,33)34)21-26(35-15)36(2)28(41)37(3)27(21)40/h6-9,11-12,18,38H,10H2,1-5H3
InChIKey
BMURWWFRZBEXDS-UHFFFAOYSA-N
Synonyms

7chloro6hydroxy46dimethoxy138trimethyl5(4(trifluoromethoxy)phenyl)1589tetrahydro2H3Hspiro(1benzofuran27pyrimido(45b)quinoline)234(3H)trione
InChI=1SC30H25ClF3N3O8c112101519(24(38)29(12)25(39)2016(424)1117(435)22(31)23(20)4529)18(136814(9713)4430(3233)34)2126(3515)36(2)28(41)37(3)27(21)40h6911121838H10H215H3
MFCD31757367
ZINC000888090103
ZINC000888090106

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Available files

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