Vitas-M small molecule compound

7-chloro-5'-(3-chloro-4-fluorophenyl)-6'-hydroxy-4,6-dimethoxy-1',3',8'-trimethyl-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
STL550347
SMILES COc1cc(OC)c(c2c1C(=O)C1(O2)C(C)CC2=Nc3c(C(C2=C1O)c1ccc(c(c1)Cl)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 C29H24Cl2FN3O7 MW 616.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24Cl2FN3O7/c1-11-8-15-19(24(36)29(11)25(37)20-16(40-4)10-17(41-5)22(31)23(20)42-29)18(12-6-7-14(32)13(30)9-12)21-26(33-15)34(2)28(39)35(3)27(21)38/h6-7,9-11,18,36H,8H2,1-5H3
InChIKey
YBJYZDRAOFUUGD-UHFFFAOYSA-N
Synonyms

7chloro5(3chloro4fluorophenyl)6hydroxy46dimethoxy138trimethyl1589tetrahydro2H3Hspiro(1benzofuran27pyrimido(45b)quinoline)234(3H)trione
InChI=1SC29H24Cl2FN3O7c11181519(24(36)29(11)25(37)2016(404)1017(415)22(31)23(20)4229)18(126714(32)13(30)912)2126(3315)34(2)28(39)35(3)27(21)38h679111836H8H215H3
MFCD31757537
ZINC000888090865
ZINC000888090868

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Available files

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