Vitas-M small molecule compound
methyl 6-tert-butyl-2-{[(2,4-dimethoxyphenyl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL174496
SMILES COc1ccc(c(c1)OC)C(=O)Nc1sc2c(c1C(=O)OC)CCC(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 C23H29NO5S MW 431.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29NO5S/c1-23(2,3)13-7-9-16-18(11-13)30-21(19(16)22(26)29-6)24-20(25)15-10-8-14(27-4)12-17(15)28-5/h8,10,12-13H,7,9,11H2,1-6H3,(H,24,25)InChIKey
WWLFPTWBEMGULN-UHFFFAOYSA-NSynonyms
438475-07-1438475071
CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=C(C=C(C=C3)OC)OC
InChI=1SC23H29NO5Sc123(23)13791618(1113)3021(19(16)22(26)296)2420(25)1510814(274)1217(15)285h8101213H7911H216H3(H2425)
methyl6tertbutyl2(((24dimethoxyphenyl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl6tertbutyl2((24dimethoxybenzoyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD02605843
ZINC000000673116
ZINC000000673117
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