Vitas-M small molecule compound
4-acetylphenyl 2-[(2-chloro-6-nitrophenyl)sulfanyl]benzoate
Catalog ID
STL015625
SMILES CC(=O)c1ccc(cc1)OC(=O)c1ccccc1Sc1c(Cl)cccc1[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 C21H14ClNO5S MW 427.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14ClNO5S/c1-13(24)14-9-11-15(12-10-14)28-21(25)16-5-2-3-8-19(16)29-20-17(22)6-4-7-18(20)23(26)27/h2-12H,1H3InChIKey
RONNXMFWKMHOMQ-UHFFFAOYSA-NSynonyms
516469-03-7(4ACETYLPHENYL)2(2CHLORO6NITROPHENYL)SULFANYLBENZOATE
4acetylphenyl2((2chloro6nitrophenyl)sulfanyl)benzoate
4acetylphenyl2((2chloro6nitrophenyl)thio)benzoate
4ACETYLPHENYL2(6CHLORO2NITROPHENYLTHIO)BENZOATE
516469037
CC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2SC3=C(C=CC=C3Cl)(N+)(=O)(O)
CC(=O)c1ccc(cc1)OC(=O)c1ccccc1Sc1c(Cl)cccc1(N+)(=O)(O)
InChI=1SC21H14ClNO5Sc113(24)1491115(121014)2821(25)16523819(16)292017(22)64718(20)23(26)27h212H1H3
MFCD03686813
ZINC000002249091
ZINC02249091
ZINC2249091
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