Vitas-M small molecule compound
(2E)-3-(4-chloro-3-nitrophenyl)-N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]prop-2-enamide
Catalog ID
STK173687
SMILES O=C(Nc1cccc(c1)c1nc2c(o1)ccc(c2)C)/C=C/c1ccc(c(c1)[N+](=O)[O-])Cl
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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 C23H16ClN3O4 MW 433.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16ClN3O4/c1-14-5-9-21-19(11-14)26-23(31-21)16-3-2-4-17(13-16)25-22(28)10-7-15-6-8-18(24)20(12-15)27(29)30/h2-13H,1H3,(H,25,28)/b10-7+InChIKey
BIAJQDOOXVEEJV-JXMROGBWSA-NSynonyms
(2E)3(4CHLORO3NITROPHENYL)N(3(5METHYL13BENZOXAZOL2YL)PHENYL)PROP2ENAMIDE
(E)3(4chloro3nitrophenyl)N(3(5methyl13benzoxazol2yl)phenyl)prop2enamide
CC1=CC2=C(C=C1)OC(=N2)C3=CC(=CC=C3)NC(=O)C=CC4=CC(=C(C=C4)Cl)(N+)(=O)(O)
InChI=1SC23H16ClN3O4c114592119(1114)2623(3121)1632417(1316)2522(28)107156818(24)20(1215)27(29)30h213H1H3(H2528)b107+
MFCD02908779
O=C(Nc1cccc(c1)c1nc2c(o1)ccc(c2)C)C=Cc1ccc(c(c1)(N+)(=O)(O))Cl
ZINC000009892099
ZINC09892099
ZINC9892099
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