Vitas-M small molecule compound
2-{[3-(methoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamoyl}cyclohexanecarboxylic acid
Catalog ID
STK430253
SMILES COC(=O)c1c(NC(=O)C2CCCCC2C(=O)O)sc2c1CCCC2
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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 C18H23NO5S MW 365.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23NO5S/c1-24-18(23)14-12-8-4-5-9-13(12)25-16(14)19-15(20)10-6-2-3-7-11(10)17(21)22/h10-11H,2-9H2,1H3,(H,19,20)(H,21,22)InChIKey
UCGQTYPPDYLQHS-UHFFFAOYSA-NSynonyms
2((3(methoxycarbonyl)4567tetrahydro1benzothiophen2yl)carbamoyl)cyclohexanecarboxylicacid
2((3methoxycarbonyl4567tetrahydro1benzothiophen2yl)carbamoyl)cyclohexane1carboxylicacid
COC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3CCCCC3C(=O)O
InChI=1SC18H23NO5Sc12418(23)1412845913(12)2516(14)1915(20)10623711(10)17(21)22h1011H29H21H3(H1920)(H2122)
MFCD01339436
ZINC000005021072
ZINC000005021077
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