Vitas-M small molecule compound
N-(2,3-dihydro-1H-inden-5-yl)-2-{[6-(2-methoxybenzyl)-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL128982
SMILES COc1ccccc1CN1CCc2c(C1)c(=O)[nH]c(n2)SCC(=O)Nc1ccc2c(c1)CCC2
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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 C26H28N4O3S MW 476.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N4O3S/c1-33-23-8-3-2-5-19(23)14-30-12-11-22-21(15-30)25(32)29-26(28-22)34-16-24(31)27-20-10-9-17-6-4-7-18(17)13-20/h2-3,5,8-10,13H,4,6-7,11-12,14-16H2,1H3,(H,27,31)(H,28,29,32)InChIKey
OYTJTNFPVRZEHW-UHFFFAOYSA-NSynonyms
COC1=CC=CC=C1CN2CCC3=C(C2)C(=O)N=C(N3)SCC(=O)NC4=CC5=C(CCC5)C=C4
COc1ccccc1CN1CCc2c(C1)c(=O)(nH)c(n2)SCC(=O)Nc1ccc2c(c1)CCC2
InChI=1SC26H28N4O3Sc13323832519(23)143012112221(1530)25(32)2926(2822)341624(31)27201091764718(17)1320h23581013H46711121416H21H3(H2731)(H282932)
MFCD20742889
N(23dihydro1Hinden5yl)2((6((2methoxyphenyl)methyl)4oxo1578tetrahydropyrido(43d)pyrimidin2yl)sulfanyl)acetamide
N(23dihydro1Hinden5yl)2((6(2methoxybenzyl)4oxo345678hexahydropyrido(43d)pyrimidin2yl)sulfanyl)acetamide
ZINC000067291434
ZINC67291434
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