Vitas-M small molecule compound
5-{[6-tert-butyl-3-(methoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-5-oxopentanoic acid
Catalog ID
STK334536
SMILES COC(=O)c1c(NC(=O)CCCC(=O)O)sc2c1CCC(C2)C(C)(C)C
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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 C19H27NO5S MW 381.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H27NO5S/c1-19(2,3)11-8-9-12-13(10-11)26-17(16(12)18(24)25-4)20-14(21)6-5-7-15(22)23/h11H,5-10H2,1-4H3,(H,20,21)(H,22,23)InChIKey
DHAOJRGMBAQRMU-UHFFFAOYSA-NSynonyms
5((6tertbutyl3(methoxycarbonyl)4567tetrahydro1benzothiophen2yl)amino)5oxopentanoicacid
5((6tertbutyl3methoxycarbonyl4567tetrahydro1benzothiophen2yl)amino)5oxopentanoicacid
CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)CCCC(=O)O
InChI=1SC19H27NO5Sc119(23)11891213(1011)2617(16(12)18(24)254)2014(21)65715(22)23h11H510H214H3(H2021)(H2223)
MFCD01243914
ZINC000002486542
ZINC000002486544
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