Vitas-M small molecule compound
ethyl 2-{[(2E)-3-(4-nitrophenyl)prop-2-enoyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STK071318
SMILES CCOC(=O)c1c(NC(=O)/C=C/c2ccc(cc2)[N+](=O)[O-])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 C19H18N2O5S MW 386.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O5S/c1-2-26-19(23)17-14-4-3-5-15(14)27-18(17)20-16(22)11-8-12-6-9-13(10-7-12)21(24)25/h6-11H,2-5H2,1H3,(H,20,22)/b11-8+InChIKey
KVICXUPNMKNDRV-DHZHZOJOSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C=CC3=CC=C(C=C3)(N+)(=O)(O)
CCOC(=O)c1c(NC(=O)C=Cc2ccc(cc2)(N+)(=O)(O))sc2c1CCC2
ETHYL2(((2E)3(4NITROPHENYL)PROP2ENOYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
ETHYL2(((E)3(4NITROPHENYL)PROP2ENOYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
InChI=1SC19H18N2O5Sc122619(23)171443515(14)2718(17)2016(22)118126913(10712)21(24)25h611H25H21H3(H2022)b118+
MFCD01180191
STK071318
ZINC000005461190
ZINC05461190
ZINC5461190
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