Vitas-M small molecule compound
methyl 2-[({[6-(2-methoxybenzyl)-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL128921
SMILES COC(=O)c1ccccc1NC(=O)CSc1nc2CCN(Cc2c(=O)[nH]1)Cc1ccccc1OC
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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/c1-33-21-10-6-3-7-16(21)13-29-12-11-20-18(14-29)23(31)28-25(27-20)35-15-22(30)26-19-9-5-4-8-17(19)24(32)34-2/h3-10H,11-15H2,1-2H3,(H,26,30)(H,27,28,31)InChIKey
XGFWSDZGMAXAMQ-UHFFFAOYSA-NSynonyms
COC(=O)c1ccccc1NC(=O)CSc1nc2CCN(Cc2c(=O)(nH)1)Cc1ccccc1OC
COC1=CC=CC=C1CN2CCC3=C(C2)C(=O)N=C(N3)SCC(=O)NC4=CC=CC=C4C(=O)OC
InChI=1SC25H26N4O5Sc133211063716(21)132912112018(1429)23(31)2825(2720)351522(30)2619954817(19)24(32)342h310H1115H212H3(H2630)(H272831)
methyl2((((6(2methoxybenzyl)4oxo345678hexahydropyrido(43d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
methyl2((2((6((2methoxyphenyl)methyl)4oxo1578tetrahydropyrido(43d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
MFCD20742845
ZINC000067291303
ZINC67291303
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