Vitas-M small molecule compound

7,7'-[(4-hydroxyphenyl)methanediyl]bis(6-hydroxy-3,4-dihydro-2H,8H-pyrimido[2,1-b][1,3]thiazin-8-one)

Catalog ID
STK560823
SMILES Oc1ccc(cc1)C(c1c(=O)nc2n(c1O)CCCS2)c1c(=O)nc2n(c1O)CCCS2

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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 C21H20N4O5S2 MW 472.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O5S2/c26-12-5-3-11(4-6-12)13(14-16(27)22-20-24(18(14)29)7-1-9-31-20)15-17(28)23-21-25(19(15)30)8-2-10-32-21/h3-6,13,26,29-30H,1-2,7-10H2
InChIKey
LKGHRYLQKXWUNU-UHFFFAOYSA-N
Synonyms

6HYDROXY7((6HYDROXY8OXO34DIHYDRO2HPYRIMIDO(21B)(13)THIAZIN7YL)(4HYDROXYPHENYL)METHYL)34DIHYDRO2HPYRIMIDO(21B)(13)THIAZIN8ONE
77((4hydroxyphenyl)methanediyl)bis(6hydroxy34dihydro2H8Hpyrimido(21b)(13)thiazin8one)
8HYDROXY7((8HYDROXY6OXO(5HYDRO2H3H4HPYRIMIDINO(21B)13THIAZAPERHYDROIN7YL))(4HYDROXYPHENYL)METHYL)5HYDRO2H3H4HPYRIMIDINO(21B)13THIAZAPERHYDROIN6ONE
C1CN2C(=C(C(=O)N=C2SC1)C(C3=CC=C(C=C3)O)C4=C(N5CCCSC5=NC4=O)O)O
InChI=1SC21H20N4O5S2c26125311(4612)13(1416(27)222024(18(14)29)7193120)1517(28)232125(19(15)30)82103221h3613262930H12710H2
MFCD03795741
ZINC000102499202
ZINC100724410
ZINC100724412
ZINC102499202
ZINC18120469

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Available files

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