Vitas-M small molecule compound
2-{[3-(methoxycarbonyl)-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamoyl}cyclohexanecarboxylic acid
Catalog ID
STK424380
SMILES COC(=O)c1c(NC(=O)C2CCCCC2C(=O)O)sc2c1CCC(C2)c1ccccc1
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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 C24H27NO5S MW 441.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27NO5S/c1-30-24(29)20-18-12-11-15(14-7-3-2-4-8-14)13-19(18)31-22(20)25-21(26)16-9-5-6-10-17(16)23(27)28/h2-4,7-8,15-17H,5-6,9-13H2,1H3,(H,25,26)(H,27,28)InChIKey
XWRKLBVHUOQXMV-UHFFFAOYSA-NSynonyms
2((3(methoxycarbonyl)6phenyl4567tetrahydro1benzothiophen2yl)carbamoyl)cyclohexanecarboxylicacid
2((3methoxycarbonyl6phenyl4567tetrahydro1benzothiophen2yl)carbamoyl)cyclohexane1carboxylicacid
COC(=O)C1=C(SC2=C1CCC(C2)C3=CC=CC=C3)NC(=O)C4CCCCC4C(=O)O
InChI=1SC24H27NO5Sc13024(29)2018121115(147324814)1319(18)3122(20)2521(26)169561017(16)23(27)28h24781517H56913H21H3(H2526)(H2728)
MFCD01924029
ZINC000004643921
ZINC000015746630
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