Vitas-M small molecule compound
propan-2-yl 6-(4-butoxy-3-methoxyphenyl)-8-methyl-4-oxo-3,4-dihydro-2H,6H-pyrimido[2,1-b][1,3]thiazine-7-carboxylate
Catalog ID
STK815342
SMILES CCCCOc1ccc(cc1OC)C1N2C(=O)CCSC2=NC(=C1C(=O)OC(C)C)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 C23H30N2O5S MW 446.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N2O5S/c1-6-7-11-29-17-9-8-16(13-18(17)28-5)21-20(22(27)30-14(2)3)15(4)24-23-25(21)19(26)10-12-31-23/h8-9,13-14,21H,6-7,10-12H2,1-5H3InChIKey
WCLWAIXKDAXAFZ-UHFFFAOYSA-NSynonyms
618411-07-7618411077
CCCCOC1=C(C=C(C=C1)C2C(=C(N=C3N2C(=O)CCS3)C)C(=O)OC(C)C)OC
InChI=1SC23H30N2O5Sc1671129179816(1318(17)285)2120(22(27)3014(2)3)15(4)242325(21)19(26)10123123h89131421H671012H215H3
METHYLETHYL6(4BUTOXY3METHOXYPHENYL)8METHYL4OXO56DIHYDRO2H3HPYRIMIDINO(21B)13THIAZAPERHYDROINE7CARBOXYLATE
MFCD03530154
propan2yl6(4butoxy3methoxyphenyl)8methyl4oxo34dihydro2H6Hpyrimido(21b)(13)thiazine7carboxylate
PROPAN2YL6(4BUTOXY3METHOXYPHENYL)8METHYL4OXO36DIHYDRO2HPYRIMIDO(21B)(13)THIAZINE7CARBOXYLATE
ZINC000002508884
ZINC000016805599
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