Vitas-M small molecule compound

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

Catalog ID
STK846775
SMILES Clc1ccc(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 C21H19ClN4O4S2 MW 490.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN4O4S2/c22-12-5-3-11(4-6-12)13(14-16(27)23-20-25(18(14)29)7-1-9-31-20)15-17(28)24-21-26(19(15)30)8-2-10-32-21/h3-6,13,29-30H,1-2,7-10H2
InChIKey
UAYCSIBBMAZQQU-UHFFFAOYSA-N
Synonyms

7((4CHLOROPHENYL)(6HYDROXY8OXO34DIHYDRO2HPYRIMIDO(21B)(13)THIAZIN7YL)METHYL)6HYDROXY34DIHYDRO2HPYRIMIDO(21B)(13)THIAZIN8ONE
7((4CHLOROPHENYL)(8HYDROXY6OXO34DIHYDRO2H6HPYRIMIDO(21B)(13)THIAZIN7YL)METHYL)8HYDROXY34DIHYDRO2H6HPYRIMIDO(21B)(13)THIAZIN6ONE
77((4chlorophenyl)methanediyl)bis(6hydroxy34dihydro2H8Hpyrimido(21b)(13)thiazin8one)
C1CN2C(=C(C(=O)N=C2SC1)C(C3=CC=C(C=C3)Cl)C4=C(N5CCCSC5=NC4=O)O)O
InChI=1SC21H19ClN4O4S2c22125311(4612)13(1416(27)232025(18(14)29)7193120)1517(28)242126(19(15)30)82103221h36132930H12710H2
MFCD03815590
ZINC000102799665
ZINC09183610
ZINC09183611
ZINC102799665
ZINC15919624
ZINC9183610
ZINC9183611

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.