Vitas-M small molecule compound
3-[(benzylsulfonyl)amino]-3-(3-nitrophenyl)propanoic acid
Catalog ID
STK679965
SMILES OC(=O)CC(c1cccc(c1)[N+](=O)[O-])NS(=O)(=O)Cc1ccccc1
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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 C16H16N2O6S MW 364.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O6S/c19-16(20)10-15(13-7-4-8-14(9-13)18(21)22)17-25(23,24)11-12-5-2-1-3-6-12/h1-9,15,17H,10-11H2,(H,19,20)InChIKey
VLQJDYZLSCDHME-UHFFFAOYSA-NSynonyms
(3S)3((BENZYLSULFONYL)AMINO)3(3NITROPHENYL)PROPANOICACID
3((benzylsulfonyl)amino)3(3nitrophenyl)propanoicacid
3(3NITROPHENYL)3((BENZYLSULFONYL)AMINO)PROPANOICACID
3(BENZYLSULFONYLAMINO)3(3NITROPHENYL)PROPANOICACID
C1=CC=C(C=C1)CS(=O)(=O)NC(CC(=O)O)C2=CC(=CC=C2)(N+)(=O)(O)
InChI=1SC16H16N2O6Sc1916(20)1015(1374814(913)18(21)22)1725(2324)11125213612h191517H1011H2(H1920)
MFCD03766542
OC(=O)CC(c1cccc(c1)(N+)(=O)(O))NS(=O)(=O)Cc1ccccc1
ZINC000004601059
ZINC000004601062
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