Vitas-M small molecule compound
4-{[6-tert-butyl-3-(methoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino}-4-oxobutanoic acid
Catalog ID
STK430038
SMILES COC(=O)c1c(NC(=O)CCC(=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 C18H25NO5S MW 367.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H25NO5S/c1-18(2,3)10-5-6-11-12(9-10)25-16(15(11)17(23)24-4)19-13(20)7-8-14(21)22/h10H,5-9H2,1-4H3,(H,19,20)(H,21,22)InChIKey
FOCPDNCUJACZMK-UHFFFAOYSA-NSynonyms
4((6tertbutyl3(methoxycarbonyl)4567tetrahydro1benzothiophen2yl)amino)4oxobutanoicacid
4((6tertbutyl3methoxycarbonyl4567tetrahydro1benzothiophen2yl)amino)4oxobutanoicacid
CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)CCC(=O)O
InChI=1SC18H25NO5Sc118(23)10561112(910)2516(15(11)17(23)244)1913(20)7814(21)22h10H59H214H3(H1920)(H2122)
MFCD01353650
ZINC000004124200
ZINC000004124201
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