Vitas-M small molecule compound
5-chloro-N-[3-(ethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(methylsulfonyl)pyrimidine-4-carboxamide
Catalog ID
STK907923
SMILES CCNC(=O)c1c(NC(=O)c2nc(ncc2Cl)S(=O)(=O)C)sc2c1CCCC2
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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 C17H19ClN4O4S2 MW 442.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19ClN4O4S2/c1-3-19-14(23)12-9-6-4-5-7-11(9)27-16(12)22-15(24)13-10(18)8-20-17(21-13)28(2,25)26/h8H,3-7H2,1-2H3,(H,19,23)(H,22,24)InChIKey
MTDDQLPDEQJOGB-UHFFFAOYSA-NSynonyms
5chloroN(3(ethylcarbamoyl)4567tetrahydro1benzothiophen2yl)2(methylsulfonyl)pyrimidine4carboxamide
5chloroN(3(ethylcarbamoyl)4567tetrahydro1benzothiophen2yl)2methylsulfonylpyrimidine4carboxamide
CCNC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=NC(=NC=C3Cl)S(=O)(=O)C
InChI=1SC17H19ClN4O4S2c131914(23)129645711(9)2716(12)2215(24)1310(18)82017(2113)28(225)26h8H37H212H3(H1923)(H2224)
MFCD06647414
ZINC000016751812
ZINC16751812
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