Vitas-M small molecule compound
4-propanoylphenyl 2-[(4-nitrophenyl)sulfanyl]benzoate
Catalog ID
STK388797
SMILES CCC(=O)c1ccc(cc1)OC(=O)c1ccccc1Sc1ccc(cc1)[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 C22H17NO5S MW 407.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17NO5S/c1-2-20(24)15-7-11-17(12-8-15)28-22(25)19-5-3-4-6-21(19)29-18-13-9-16(10-14-18)23(26)27/h3-14H,2H2,1H3InChIKey
QQQGHPQCKRRTKO-UHFFFAOYSA-NSynonyms
431977-00-3(4PROPANOYLPHENYL)2(4NITROPHENYL)SULFANYLBENZOATE
431977003
4propanoylphenyl2((4nitrophenyl)sulfanyl)benzoate
4PROPANOYLPHENYL2(4NITROPHENYLTHIO)BENZOATE
CCC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2SC3=CC=C(C=C3)(N+)(=O)(O)
CCC(=O)c1ccc(cc1)OC(=O)c1ccccc1Sc1ccc(cc1)(N+)(=O)(O)
InChI=1SC22H17NO5Sc1220(24)1571117(12815)2822(25)19534621(19)291813916(101418)23(26)27h314H2H21H3
MFCD03103697
ZINC000001145367
ZINC01145367
ZINC1145367
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