Vitas-M small molecule compound
5-chloro-N-[3-(methylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-(propylsulfonyl)pyrimidine-4-carboxamide
Catalog ID
STK909349
SMILES CCCS(=O)(=O)c1ncc(c(n1)C(=O)Nc1sc2c(c1C(=O)NC)CCCC2)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 C18H21ClN4O4S2 MW 456.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21ClN4O4S2/c1-3-8-29(26,27)18-21-9-11(19)14(22-18)16(25)23-17-13(15(24)20-2)10-6-4-5-7-12(10)28-17/h9H,3-8H2,1-2H3,(H,20,24)(H,23,25)InChIKey
HWCDRQVIPUEGMQ-UHFFFAOYSA-NSynonyms
5chloroN(3(methylcarbamoyl)4567tetrahydro1benzothiophen2yl)2(propylsulfonyl)pyrimidine4carboxamide
5chloroN(3(methylcarbamoyl)4567tetrahydro1benzothiophen2yl)2propylsulfonylpyrimidine4carboxamide
CCCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NC)Cl
InChI=1SC18H21ClN4O4S2c13829(2627)1821911(19)14(2218)16(25)231713(15(24)202)10645712(10)2817h9H38H212H3(H2024)(H2325)
MFCD06648546
ZINC000016753814
ZINC16753814
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