Vitas-M small molecule compound
5-chloro-N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-(4-ethylbenzyl)-2-(propylsulfonyl)pyrimidine-4-carboxamide
Catalog ID
STK910081
SMILES CCCS(=O)(=O)c1ncc(c(n1)C(=O)N(C1CCS(=O)(=O)C1)Cc1ccc(cc1)CC)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 C21H26ClN3O5S2 MW 500.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26ClN3O5S2/c1-3-10-32(29,30)21-23-12-18(22)19(24-21)20(26)25(17-9-11-31(27,28)14-17)13-16-7-5-15(4-2)6-8-16/h5-8,12,17H,3-4,9-11,13-14H2,1-2H3InChIKey
LOTOVMZRBRYLCU-UHFFFAOYSA-NSynonyms
5chloroN(11dioxidotetrahydrothiophen3yl)N(4ethylbenzyl)2(propylsulfonyl)pyrimidine4carboxamide
5chloroN(11dioxothiolan3yl)N((4ethylphenyl)methyl)2propylsulfonylpyrimidine4carboxamide
CCCS(=O)(=O)C1=NC=C(C(=N1)C(=O)N(CC2=CC=C(C=C2)CC)C3CCS(=O)(=O)C3)Cl
InChI=1SC21H26ClN3O5S2c131032(2930)21231218(22)19(2421)20(26)25(1791131(2728)1417)13167515(42)6816h581217H349111314H212H3
MFCD06649189
ZINC000008868487
ZINC000008868491
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