Vitas-M small molecule compound
(2E)-2-(4-methylbenzylidene)-6-(4-propoxybenzyl)-7H-[1,3]thiazolo[3,2-b][1,2,4]triazine-3,7(2H)-dione
Catalog ID
STK705042
SMILES CCCOc1ccc(cc1)Cc1nn2c(nc1=O)s/c(=C/c1ccc(cc1)C)/c2=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 C23H21N3O3S MW 419.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O3S/c1-3-12-29-18-10-8-16(9-11-18)13-19-21(27)24-23-26(25-19)22(28)20(30-23)14-17-6-4-15(2)5-7-17/h4-11,14H,3,12-13H2,1-2H3/b20-14+InChIKey
PWCVGVFWPCMQRA-XSFVSMFZSA-NSynonyms
(2E)2((4METHYLPHENYL)METHYLIDENE)6((4PROPOXYPHENYL)METHYL)(13)THIAZOLO(32B)(124)TRIAZINE37DIONE
(2E)2(4methylbenzylidene)6(4propoxybenzyl)7H(13)thiazolo(32b)(124)triazine37(2H)dione
(Z)2(4methylbenzylidene)6(4propoxybenzyl)2Hthiazolo(32b)(124)triazine37dione
CCCOC1=CC=C(C=C1)CC2=NN3C(=O)C(=CC4=CC=C(C=C4)C)SC3=NC2=O
CCCOc1ccc(cc1)Cc1nn2c(nc1=O)sc(=Cc1ccc(cc1)C)c2=O
InChI=1SC23H21N3O3Sc1312291810816(91118)131921(27)242326(2519)22(28)20(3023)14176415(2)5717h41114H31213H212H3b2014+
MFCD04551355
ZINC000005006627
ZINC05006627
ZINC5006627
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