Vitas-M small molecule compound
methyl 2-{[(2E)-3-(2,6-dichlorophenyl)prop-2-enoyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STK433369
SMILES COC(=O)c1c(NC(=O)/C=C/c2c(Cl)cccc2Cl)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 C18H15Cl2NO3S MW 396.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15Cl2NO3S/c1-24-18(23)16-11-4-2-7-14(11)25-17(16)21-15(22)9-8-10-12(19)5-3-6-13(10)20/h3,5-6,8-9H,2,4,7H2,1H3,(H,21,22)/b9-8+InChIKey
JTAPBKDSRVRVPL-CMDGGOBGSA-NSynonyms
COC(=O)C1=C(SC2=C1CCC2)NC(=O)C=CC3=C(C=CC=C3Cl)Cl
COC(=O)c1c(NC(=O)C=Cc2c(Cl)cccc2Cl)sc2c1CCC2
InChI=1SC18H15Cl2NO3Sc12418(23)161142714(11)2517(16)2115(22)981012(19)53613(10)20h35689H247H21H3(H2122)b98+
methyl2(((2E)3(26dichlorophenyl)prop2enoyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
METHYL2(((E)3(26DICHLOROPHENYL)PROP2ENOYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
METHYL2((2E)3(26DICHLOROPHENYL)PROP2ENOYLAMINO)456TRIHYDROCYCLOPENTA(21B)THIOPHENE3CARBOXYLATE
MFCD03367611
ZINC000001112770
ZINC01112770
ZINC1112770
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