Vitas-M small molecule compound
5-chloro-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(ethylsulfanyl)-N-(4-propoxybenzyl)pyrimidine-4-carboxamide
Catalog ID
STK910352
SMILES CCCOc1ccc(cc1)CN(C(=O)c1nc(SCC)ncc1Cl)C1CCS(=O)(=O)C1
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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 C21H26ClN3O4S2 MW 484.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26ClN3O4S2/c1-3-10-29-17-7-5-15(6-8-17)13-25(16-9-11-31(27,28)14-16)20(26)19-18(22)12-23-21(24-19)30-4-2/h5-8,12,16H,3-4,9-11,13-14H2,1-2H3InChIKey
RFHPADPTMXNEKE-UHFFFAOYSA-NSynonyms
832683-74-65chloroN(11dioxidotetrahydrothiophen3yl)2(ethylsulfanyl)N(4propoxybenzyl)pyrimidine4carboxamide
5CHLORON(11DIOXOTHIOLAN3YL)2ETHYLSULFANYLN((4PROPOXYPHENYL)METHYL)PYRIMIDINE4CARBOXAMIDE
832683746
CCCOC1=CC=C(C=C1)CN(C2CCS(=O)(=O)C2)C(=O)C3=NC(=NC=C3Cl)SCC
InChI=1SC21H26ClN3O4S2c131029177515(6817)1325(1691131(2728)1416)20(26)1918(22)122321(2419)3042h581216H349111314H212H3
MFCD06628607
ZINC000008868987
ZINC000009431798
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