Vitas-M small molecule compound
5-chloro-N-[4-(dimethylamino)benzyl]-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(ethylsulfanyl)pyrimidine-4-carboxamide
Catalog ID
STK908317
SMILES CCSc1ncc(c(n1)C(=O)N(C1CCS(=O)(=O)C1)Cc1ccc(cc1)N(C)C)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 C20H25ClN4O3S2 MW 469.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25ClN4O3S2/c1-4-29-20-22-11-17(21)18(23-20)19(26)25(16-9-10-30(27,28)13-16)12-14-5-7-15(8-6-14)24(2)3/h5-8,11,16H,4,9-10,12-13H2,1-3H3InChIKey
UBQBAURJAMTQHI-UHFFFAOYSA-NSynonyms
5chloroN((4(dimethylamino)phenyl)methyl)N(11dioxothiolan3yl)2ethylsulfanylpyrimidine4carboxamide
5CHLORON((4DIMETHYLAMINOPHENYL)METHYL)N(11DIOXOTHIOLAN3YL)2ETHYLSULFANYLPYRIMIDINE4CARBOXAMIDE
5CHLORON(4(DIMETHYLAMINO)BENZYL)N(11DIOXIDOTETRAHYDRO3THIENYL)2(ETHYLTHIO)4PYRIMIDINECARBOXAMIDE
5chloroN(4(dimethylamino)benzyl)N(11dioxidotetrahydrothiophen3yl)2(ethylsulfanyl)pyrimidine4carboxamide
CCSC1=NC=C(C(=N1)C(=O)N(CC2=CC=C(C=C2)N(C)C)C3CCS(=O)(=O)C3)Cl
InChI=1SC20H25ClN4O3S2c142920221117(21)18(2320)19(26)25(1691030(2728)1316)12145715(8614)24(2)3h581116H49101213H213H3
MFCD06632704
ZINC000004058135
ZINC000004058136
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