Vitas-M small molecule compound
methyl 2-{[(4-methyl-2-nitrophenoxy)acetyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STK472128
SMILES COC(=O)c1c(NC(=O)COc2ccc(cc2[N+](=O)[O-])C)sc2c1CCC2
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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 C18H18N2O6S MW 390.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O6S/c1-10-6-7-13(12(8-10)20(23)24)26-9-15(21)19-17-16(18(22)25-2)11-4-3-5-14(11)27-17/h6-8H,3-5,9H2,1-2H3,(H,19,21)InChIKey
ZBUZNCHXOWGVAH-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1)OCC(=O)NC2=C(C3=C(S2)CCC3)C(=O)OC)(N+)(=O)(O)
COC(=O)c1c(NC(=O)COc2ccc(cc2(N+)(=O)(O))C)sc2c1CCC2
InChI=1SC18H18N2O6Sc1106713(12(810)20(23)24)26915(21)191716(18(22)252)1143514(11)2717h68H359H212H3(H1921)
methyl2(((4methyl2nitrophenoxy)acetyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
METHYL2((2(4METHYL2NITROPHENOXY)ACETYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
METHYL2(2(4METHYL2NITROPHENOXY)ACETYLAMINO)456TRIHYDROCYCLOPENTA(21B)THIOPHENE3CARBOXYLATE
MFCD07626091
ZINC000006690869
ZINC06690869
ZINC6690869
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