Vitas-M small molecule compound
propan-2-yl 2-{[(3,4-dimethoxyphenyl)acetyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK424834
SMILES COc1cc(ccc1OC)CC(=O)Nc1sc2c(c1C(=O)OC(C)C)CCC(C2)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 C23H29NO5S MW 431.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29NO5S/c1-13(2)29-23(26)21-16-8-6-14(3)10-19(16)30-22(21)24-20(25)12-15-7-9-17(27-4)18(11-15)28-5/h7,9,11,13-14H,6,8,10,12H2,1-5H3,(H,24,25)InChIKey
XAVRGPIGLZVXJH-UHFFFAOYSA-NSynonyms
CC1CCC2=C(C1)SC(=C2C(=O)OC(C)C)NC(=O)CC3=CC(=C(C=C3)OC)OC
InChI=1SC23H29NO5Sc113(2)2923(26)21168614(3)1019(16)3022(21)2420(25)12157917(274)18(1115)285h79111314H681012H215H3(H2425)
MFCD02372090
propan2yl2(((34dimethoxyphenyl)acetyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
propan2yl2((2(34dimethoxyphenyl)acetyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
ZINC000000648114
ZINC000000648116
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