Vitas-M small molecule compound
5-({3-[(2-methoxyphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}amino)-5-oxopentanoic acid
Catalog ID
STK470989
SMILES COc1ccccc1NC(=O)c1c(NC(=O)CCCC(=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 C21H24N2O5S MW 416.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O5S/c1-28-15-9-4-3-8-14(15)22-20(27)19-13-7-2-5-10-16(13)29-21(19)23-17(24)11-6-12-18(25)26/h3-4,8-9H,2,5-7,10-12H2,1H3,(H,22,27)(H,23,24)(H,25,26)InChIKey
BCGAEBIOYUPZOI-UHFFFAOYSA-NSynonyms
5((3((2methoxyphenyl)carbamoyl)4567tetrahydro1benzothiophen2yl)amino)5oxopentanoicacid
COC1=CC=CC=C1NC(=O)C2=C(SC3=C2CCCC3)NC(=O)CCCC(=O)O
InChI=1SC21H24N2O5Sc12815943814(15)2220(27)19137251016(13)2921(19)2317(24)1161218(25)26h3489H2571012H21H3(H2227)(H2324)(H2526)
MFCD06023381
ZINC000017090660
ZINC17090660
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