Vitas-M small molecule compound
ethyl 5-carbamoyl-4-methyl-2-({[4-(phenylsulfonyl)piperazin-1-yl]acetyl}amino)thiophene-3-carboxylate
Catalog ID
STK459368
SMILES CCOC(=O)c1c(NC(=O)CN2CCN(CC2)S(=O)(=O)c2ccccc2)sc(c1C)C(=O)N
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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 C21H26N4O6S2 MW 494.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O6S2/c1-3-31-21(28)17-14(2)18(19(22)27)32-20(17)23-16(26)13-24-9-11-25(12-10-24)33(29,30)15-7-5-4-6-8-15/h4-8H,3,9-13H2,1-2H3,(H2,22,27)(H,23,26)InChIKey
XSROZFYJWHOKAW-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC=C3
ethyl2((2(4(benzenesulfonyl)piperazin1yl)acetyl)amino)5carbamoyl4methylthiophene3carboxylate
ethyl5carbamoyl4methyl2(((4(phenylsulfonyl)piperazin1yl)acetyl)amino)thiophene3carboxylate
ETHYL5CARBAMOYL4METHYL2(2(4(PHENYLSULFONYL)PIPERAZINYL)ACETYLAMINO)THIOPHENE3CARBOXYLATE
InChI=1SC21H26N4O6S2c133121(28)1714(2)18(19(22)27)3220(17)2316(26)132491125(121024)33(2930)157546815h48H3913H212H3(H22227)(H2326)
MFCD06052721
ZINC000016517974
ZINC16517974
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