Vitas-M small molecule compound
ethyl 5,5-dimethyl-2-{[(4-nitrophenyl)acetyl]amino}-4,7-dihydro-5H-thieno[2,3-c]pyran-3-carboxylate
Catalog ID
STK830719
SMILES CCOC(=O)c1c(NC(=O)Cc2ccc(cc2)[N+](=O)[O-])sc2c1CC(C)(C)OC2
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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 C20H22N2O6S MW 418.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O6S/c1-4-27-19(24)17-14-10-20(2,3)28-11-15(14)29-18(17)21-16(23)9-12-5-7-13(8-6-12)22(25)26/h5-8H,4,9-11H2,1-3H3,(H,21,23)InChIKey
SRMBJTGVZJQPLY-UHFFFAOYSA-NSynonyms
308106-50-5308106505
CCOC(=O)C1=C(SC2=C1CC(OC2)(C)C)NC(=O)CC3=CC=C(C=C3)(N+)(=O)(O)
CCOC(=O)c1c(NC(=O)Cc2ccc(cc2)(N+)(=O)(O))sc2c1CC(C)(C)OC2
ethyl55dimethyl2(((4nitrophenyl)acetyl)amino)47dihydro5Hthieno(23c)pyran3carboxylate
ETHYL55DIMETHYL2((2(4NITROPHENYL)ACETYL)AMINO)47DIHYDROTHIENO(23C)PYRAN3CARBOXYLATE
ethyl55dimethyl2(2(4nitrophenyl)acetamido)57dihydro4Hthieno(23c)pyran3carboxylate
InChI=1SC20H22N2O6Sc142719(24)17141020(23)281115(14)2918(17)2116(23)9125713(8612)22(25)26h58H4911H213H3(H2123)
MFCD01090008
ZINC000000751893
ZINC00751893
ZINC751893
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