Vitas-M small molecule compound
methyl 2-{[(2-nitrophenyl)sulfonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL254738
SMILES COC(=O)c1c(sc2c1CCCC2)NS(=O)(=O)c1ccccc1[N+](=O)[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 C16H16N2O6S2 MW 396.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O6S2/c1-24-16(19)14-10-6-2-4-8-12(10)25-15(14)17-26(22,23)13-9-5-3-7-11(13)18(20)21/h3,5,7,9,17H,2,4,6,8H2,1H3InChIKey
FUMQBLMFVXCSJQ-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(SC2=C1CCCC2)NS(=O)(=O)C3=CC=CC=C3(N+)(=O)(O)
COC(=O)c1c(sc2c1CCCC2)NS(=O)(=O)c1ccccc1(N+)(=O)(O)
InChI=1SC16H16N2O6S2c12416(19)1410624812(10)2515(14)1726(2223)13953711(13)18(20)21h357917H2468H21H3
methyl2(((2nitrophenyl)sulfonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((2nitrophenyl)sulfonylamino)4567tetrahydro1benzothiophene3carboxylate
MFCD01163447
ZINC000005260049
ZINC5260049
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