Vitas-M small molecule compound
methyl 6-methyl-2-[(tetrahydrofuran-2-ylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK418390
SMILES COC(=O)c1c(NC(=O)C2CCCO2)sc2c1CCC(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 C16H21NO4S MW 323.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21NO4S/c1-9-5-6-10-12(8-9)22-15(13(10)16(19)20-2)17-14(18)11-4-3-7-21-11/h9,11H,3-8H2,1-2H3,(H,17,18)InChIKey
BTPPXHVFAFFOAJ-UHFFFAOYSA-NSynonyms
315685-77-9315685779
CC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3CCCO3
InChI=1SC16H21NO4Sc19561012(89)2215(13(10)16(19)202)1714(18)114372111h911H38H212H3(H1718)
methyl6methyl2((tetrahydrofuran2ylcarbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl6methyl2(oxolane2carbonylamino)4567tetrahydro1benzothiophene3carboxylate
MFCD01920628
ZINC000000087750
ZINC000000087760
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