Vitas-M small molecule compound
3-[(2,1,3-benzothiadiazol-4-ylsulfonyl)amino]-3-(4-methoxyphenyl)propanoic acid
Catalog ID
STK677751
SMILES COc1ccc(cc1)C(NS(=O)(=O)c1cccc2c1nsn2)CC(=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 C16H15N3O5S2 MW 393.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N3O5S2/c1-24-11-7-5-10(6-8-11)13(9-15(20)21)19-26(22,23)14-4-2-3-12-16(14)18-25-17-12/h2-8,13,19H,9H2,1H3,(H,20,21)InChIKey
CQUOBFDRHQJEHM-UHFFFAOYSA-NSynonyms
3((213benzothiadiazol4ylsulfonyl)amino)3(4methoxyphenyl)propanoicacid
3((BENZO(23C)125THIADIAZOL4YLSULFONYL)AMINO)3(4METHOXYPHENYL)PROPANOICACID
3(213BENZOTHIADIAZOL4YLSULFONYLAMINO)3(4METHOXYPHENYL)PROPANOICACID
COC1=CC=C(C=C1)C(CC(=O)O)NS(=O)(=O)C2=CC=CC3=NSN=C32
InChI=1SC16H15N3O5S2c124117510(6811)13(915(20)21)1926(2223)144231216(14)18251712h281319H9H21H3(H2021)
MFCD03035837
ZINC000004576916
ZINC000004576918
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