Vitas-M small molecule compound
5-methoxy-2-[(2E)-3-(thiophen-2-yl)prop-2-enoyl]phenyl 4-nitrobenzoate
Catalog ID
STK888260
SMILES COc1ccc(c(c1)OC(=O)c1ccc(cc1)[N+](=O)[O-])C(=O)/C=C/c1cccs1
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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 C21H15NO6S MW 409.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15NO6S/c1-27-16-8-10-18(19(23)11-9-17-3-2-12-29-17)20(13-16)28-21(24)14-4-6-15(7-5-14)22(25)26/h2-13H,1H3/b11-9+InChIKey
BXRHEALKBSHTBT-PKNBQFBNSA-NSynonyms
433320-95-7(5METHOXY2((E)3THIOPHEN2YLPROP2ENOYL)PHENYL)4NITROBENZOATE
(E)5methoxy2(3(thiophen2yl)acryloyl)phenyl4nitrobenzoate
2((2E)3(2THIENYL)PROP2ENOYL)5METHOXYPHENYL4NITROBENZOATE
433320957
5methoxy2((2E)3(thiophen2yl)prop2enoyl)phenyl4nitrobenzoate
COC1=CC(=C(C=C1)C(=O)C=CC2=CC=CS2)OC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
COc1ccc(c(c1)OC(=O)c1ccc(cc1)(N+)(=O)(O))C(=O)C=Cc1cccs1
InChI=1SC21H15NO6Sc1271681018(19(23)1191732122917)20(1316)2821(24)144615(7514)22(25)26h213H1H3b119+
MFCD03302482
ZINC000004279059
ZINC04279059
ZINC4279059
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