Vitas-M small molecule compound
methyl 2-(3-formyl-2,5-dimethyl-1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL371722
SMILES COC(=O)c1c(sc2c1CCCC2)n1c(C)cc(c1C)C=O
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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 C17H19NO3S MW 317.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19NO3S/c1-10-8-12(9-19)11(2)18(10)16-15(17(20)21-3)13-6-4-5-7-14(13)22-16/h8-9H,4-7H2,1-3H3InChIKey
OXFIWBCFEMDNNG-UHFFFAOYSA-NSynonyms
CC1=CC(=C(N1C2=C(C3=C(S2)CCCC3)C(=O)OC)C)C=O
InChI=1SC17H19NO3Sc110812(919)11(2)18(10)1615(17(20)213)13645714(13)2216h89H47H213H3
methyl2(3formyl25dimethyl1Hpyrrol1yl)4567tetrahydro1benzothiophene3carboxylate
methyl2(3formyl25dimethylpyrrol1yl)4567tetrahydro1benzothiophene3carboxylate
MFCD02197508
ZINC000000449316
ZINC00449316
ZINC449316
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