Vitas-M small molecule compound

(5E)-5-({1-[3-(4-tert-butylphenoxy)propyl]-1H-indol-3-yl}methylidene)-3-(4-fluorophenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione

Catalog ID
STL148491
SMILES Fc1ccc(cc1)N1C(=O)N=C(/C(=C\c2cn(c3c2cccc3)CCCOc2ccc(cc2)C(C)(C)C)/C1=O)O

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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 C32H30FN3O4 MW 539.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H30FN3O4/c1-32(2,3)22-9-15-25(16-10-22)40-18-6-17-35-20-21(26-7-4-5-8-28(26)35)19-27-29(37)34-31(39)36(30(27)38)24-13-11-23(33)12-14-24/h4-5,7-16,19-20H,6,17-18H2,1-3H3,(H,34,37,39)/b27-19+
InChIKey
IMASPOZGASPTMJ-ZXVVBBHZSA-N
Synonyms
673494-65-0
(5E)5((1(3(4tertbutylphenoxy)propyl)1Hindol3yl)methylidene)3(4fluorophenyl)6hydroxypyrimidine24(3H5H)dione
(5E)5((1(3(4TERTBUTYLPHENOXY)PROPYL)INDOL3YL)METHYLIDENE)1(4FLUOROPHENYL)13DIAZINANE246TRIONE
673494650
CC(C)(C)C1=CC=C(C=C1)OCCCN2C=C(C3=CC=CC=C32)C=C4C(=O)NC(=O)N(C4=O)C5=CC=C(C=C5)F
Fc1ccc(cc1)N1C(=O)N=C(C(=Cc2cn(c3c2cccc3)CCCOc2ccc(cc2)C(C)(C)C)C1=O)O
InChI=1SC32H30FN3O4c132(23)2291525(161022)4018617352021(26745828(26)35)192729(37)3431(39)36(30(27)38)24131123(33)121424h457161920H61718H213H3(H343739)b2719+
MFCD04080420
ZINC000097970952
ZINC97970952

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Available files

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