Vitas-M small molecule compound
diethyl 3-methyl-5-({[3-nitro-4-(piperidin-1-yl)phenyl]carbonyl}amino)thiophene-2,4-dicarboxylate
Catalog ID
STK355299
SMILES CCOC(=O)c1c(NC(=O)c2ccc(c(c2)[N+](=O)[O-])N2CCCCC2)sc(c1C)C(=O)OCC
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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 C23H27N3O7S MW 489.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O7S/c1-4-32-22(28)18-14(3)19(23(29)33-5-2)34-21(18)24-20(27)15-9-10-16(17(13-15)26(30)31)25-11-7-6-8-12-25/h9-10,13H,4-8,11-12H2,1-3H3,(H,24,27)InChIKey
HBMQZIBCYKWQDZ-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CC(=C(C=C2)N3CCCCC3)(N+)(=O)(O)
CCOC(=O)c1c(NC(=O)c2ccc(c(c2)(N+)(=O)(O))N2CCCCC2)sc(c1C)C(=O)OCC
diethyl3methyl5(((3nitro4(piperidin1yl)phenyl)carbonyl)amino)thiophene24dicarboxylate
DIETHYL3METHYL5((3NITRO4PIPERIDIN1YLBENZOYL)AMINO)THIOPHENE24DICARBOXYLATE
InChI=1SC23H27N3O7Sc143222(28)1814(3)19(23(29)3352)3421(18)2420(27)1591016(17(1315)26(30)31)25117681225h91013H481112H213H3(H2427)
MFCD05810761
ZINC000016383873
ZINC16383873
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