Vitas-M small molecule compound
2-{[(3-chloro-6-nitro-1-benzothiophen-2-yl)carbonyl]amino}benzoic acid
Catalog ID
STK095098
SMILES O=C(c1sc2c(c1Cl)ccc(c2)[N+](=O)[O-])Nc1ccccc1C(=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 C16H9ClN2O5S MW 376.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H9ClN2O5S/c17-13-10-6-5-8(19(23)24)7-12(10)25-14(13)15(20)18-11-4-2-1-3-9(11)16(21)22/h1-7H,(H,18,20)(H,21,22)InChIKey
WBVRXGQLLWNFHD-UHFFFAOYSA-NSynonyms
314039-87-72(((3CHLORO6NITRO1BENZOTHIOPHEN2YL)CARBONYL)AMINO)BENZOICACID
2((3CHLORO6NITRO1BENZOTHIOPHENE2CARBONYL)AMINO)BENZOICACID
2(3chloro6nitrobenzo(b)thiophene2carboxamido)benzoicacid
314039877
C1=CC=C(C(=C1)C(=O)O)NC(=O)C2=C(C3=C(S2)C=C(C=C3)(N+)(=O)(O))Cl
InChI=1SC16H9ClN2O5Sc171310658(19(23)24)712(10)2514(13)15(20)181142139(11)16(21)22h17H(H1820)(H2122)
MFCD01796335
O=C(c1sc2c(c1Cl)ccc(c2)(N+)(=O)(O))Nc1ccccc1C(=O)O
STK095098
ZINC000002266414
ZINC2266414
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