Vitas-M small molecule compound
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[6-(2-methoxybenzyl)-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL128967
SMILES COc1ccccc1CN1CCc2c(C1)c(=O)[nH]c(n2)SCC(=O)Nc1ccc2c(c1)OCCO2
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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 C25H26N4O5S MW 494.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O5S/c1-32-20-5-3-2-4-16(20)13-29-9-8-19-18(14-29)24(31)28-25(27-19)35-15-23(30)26-17-6-7-21-22(12-17)34-11-10-33-21/h2-7,12H,8-11,13-15H2,1H3,(H,26,30)(H,27,28,31)InChIKey
VYCKLFPMXSAPDM-UHFFFAOYSA-NSynonyms
1111136-75-41111136754
COC1=CC=CC=C1CN2CCC3=C(C2)C(=O)N=C(N3)SCC(=O)NC4=CC5=C(C=C4)OCCO5
COc1ccccc1CN1CCc2c(C1)c(=O)(nH)c(n2)SCC(=O)Nc1ccc2c(c1)OCCO2
InChI=1SC25H26N4O5Sc13220532416(20)1329981918(1429)24(31)2825(2719)351523(30)2617672122(1217)3411103321h2712H8111315H21H3(H2630)(H272831)
MFCD16640593
N(23dihydro14benzodioxin6yl)2((6((2methoxyphenyl)methyl)4oxo1578tetrahydropyrido(43d)pyrimidin2yl)sulfanyl)acetamide
N(23dihydro14benzodioxin6yl)2((6(2methoxybenzyl)4oxo345678hexahydropyrido(43d)pyrimidin2yl)sulfanyl)acetamide
ZINC000033331790
ZINC33331790
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