Vitas-M small molecule compound
methyl 6-[3-methoxy-4-(pentyloxy)phenyl]-8-methyl-4-oxo-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
Catalog ID
STK815448
SMILES CCCCCOc1ccc(cc1OC)C1N2C(=O)CCSC2=NC(=C1C(=O)OC)C
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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 C22H28N2O5S MW 432.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N2O5S/c1-5-6-7-11-29-16-9-8-15(13-17(16)27-3)20-19(21(26)28-4)14(2)23-22-24(20)18(25)10-12-30-22/h8-9,13,20H,5-7,10-12H2,1-4H3InChIKey
TTXDWEDXDZTWMZ-UHFFFAOYSA-NSynonyms
620157-28-0620157280
CCCCCOC1=C(C=C(C=C1)C2C(=C(N=C3N2C(=O)CCS3)C)C(=O)OC)OC
InChI=1SC22H28N2O5Sc15671129169815(1317(16)273)2019(21(26)284)14(2)232224(20)18(25)10123022h891320H571012H214H3
methyl6(3methoxy4(pentyloxy)phenyl)8methyl4oxo34dihydro2H6Hpyrimido(21b)(13)thiazine7carboxylate
METHYL6(3METHOXY4PENTOXYPHENYL)8METHYL4OXO36DIHYDRO2HPYRIMIDO(21B)(13)THIAZINE7CARBOXYLATE
MFCD03530164
ZINC000002487033
ZINC000002487034
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