Vitas-M small molecule compound
N-[2-(cyclohex-1-en-1-yl)ethyl]-2-{[6-(2-methoxybenzyl)-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL128915
SMILES COc1ccccc1CN1CCc2c(C1)c(=O)[nH]c(n2)SCC(=O)NCCC1=CCCCC1
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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 C25H32N4O3S MW 468.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N4O3S/c1-32-22-10-6-5-9-19(22)15-29-14-12-21-20(16-29)24(31)28-25(27-21)33-17-23(30)26-13-11-18-7-3-2-4-8-18/h5-7,9-10H,2-4,8,11-17H2,1H3,(H,26,30)(H,27,28,31)InChIKey
JTHRGWMJYBLYKM-UHFFFAOYSA-NSynonyms
COC1=CC=CC=C1CN2CCC3=C(C2)C(=O)N=C(N3)SCC(=O)NCCC4=CCCCC4
COc1ccccc1CN1CCc2c(C1)c(=O)(nH)c(n2)SCC(=O)NCCC1=CCCCC1
InChI=1SC25H32N4O3Sc132221065919(22)152914122120(1629)24(31)2825(2721)331723(30)261311187324818h57910H2481117H21H3(H2630)(H272831)
MFCD20742840
N(2(cyclohex1en1yl)ethyl)2((6(2methoxybenzyl)4oxo345678hexahydropyrido(43d)pyrimidin2yl)sulfanyl)acetamide
N(2(cyclohexen1yl)ethyl)2((6((2methoxyphenyl)methyl)4oxo1578tetrahydropyrido(43d)pyrimidin2yl)sulfanyl)acetamide
ZINC000067291275
ZINC67291275
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