Vitas-M small molecule compound
N-(4-chlorobenzyl)-2-{[6-(4-fluorobenzyl)-4-oxo-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL129054
SMILES O=C(CSc1nc2CCN(Cc2c(=O)[nH]1)Cc1ccc(cc1)F)NCc1ccc(cc1)Cl
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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 C23H22ClFN4O2S MW 472.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClFN4O2S/c24-17-5-1-15(2-6-17)11-26-21(30)14-32-23-27-20-9-10-29(13-19(20)22(31)28-23)12-16-3-7-18(25)8-4-16/h1-8H,9-14H2,(H,26,30)(H,27,28,31)InChIKey
FLSAGUQVMHFIKW-UHFFFAOYSA-NSynonyms
946293-35-2946293352
C1CN(CC2=C1NC(=NC2=O)SCC(=O)NCC3=CC=C(C=C3)Cl)CC4=CC=C(C=C4)F
InChI=1SC23H22ClFN4O2Sc24175115(2617)112621(30)143223272091029(1319(20)22(31)2823)12163718(25)8416h18H914H2(H2630)(H272831)
MFCD09981022
N((4chlorophenyl)methyl)2((6((4fluorophenyl)methyl)4oxo1578tetrahydropyrido(43d)pyrimidin2yl)sulfanyl)acetamide
N(4chlorobenzyl)2((6(4fluorobenzyl)4oxo345678hexahydropyrido(43d)pyrimidin2yl)sulfanyl)acetamide
O=C(CSc1nc2CCN(Cc2c(=O)(nH)1)Cc1ccc(cc1)F)NCc1ccc(cc1)Cl
ZINC000012415257
ZINC12415257
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