Vitas-M small molecule compound
methyl 2-{[(3-oxopiperazin-2-yl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL019111
SMILES COC(=O)c1c(NC(=O)CC2NCCNC2=O)sc2c1CCCC2
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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 C16H21N3O4S MW 351.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N3O4S/c1-23-16(22)13-9-4-2-3-5-11(9)24-15(13)19-12(20)8-10-14(21)18-7-6-17-10/h10,17H,2-8H2,1H3,(H,18,21)(H,19,20)InChIKey
MITCBABBSMXUOC-UHFFFAOYSA-NSynonyms
1008965-22-71008965227
COC(=O)C1=C(SC2=C1CCCC2)NC(=O)CC3C(=O)NCCN3
InChI=1SC16H21N3O4Sc12316(22)139423511(9)2415(13)1912(20)81014(21)18761710h1017H28H21H3(H1821)(H1920)
methyl2(((3oxopiperazin2yl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((2(3oxopiperazin2yl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD05718956
ZINC000054240842
ZINC000054240844
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