Vitas-M small molecule compound
ethyl 2-{[(2E)-3-(2-chlorophenyl)prop-2-enoyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Catalog ID
STK418785
SMILES CCOC(=O)c1c(NC(=O)/C=C/c2ccccc2Cl)sc2c1CCCCCC2
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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 C22H24ClNO3S MW 417.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24ClNO3S/c1-2-27-22(26)20-16-10-5-3-4-6-12-18(16)28-21(20)24-19(25)14-13-15-9-7-8-11-17(15)23/h7-9,11,13-14H,2-6,10,12H2,1H3,(H,24,25)/b14-13+InChIKey
KNEUEEUACNKIHI-BUHFOSPRSA-NSynonyms
352682-14-5352682145
CCOC(=O)C1=C(SC2=C1CCCCCC2)NC(=O)C=CC3=CC=CC=C3Cl
CCOC(=O)c1c(NC(=O)C=Cc2ccccc2Cl)sc2c1CCCCCC2
ethyl2(((2E)3(2chlorophenyl)prop2enoyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
ethyl2(((E)3(2chlorophenyl)prop2enoyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
InChI=1SC22H24ClNO3Sc122722(26)20161053461218(16)2821(20)2419(25)1413159781117(15)23h79111314H261012H21H3(H2425)b1413+
MFCD01351423
ZINC000002739277
ZINC02739277
ZINC2739277
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