Vitas-M small molecule compound

(2E)-3-(4-chloro-3-nitrophenyl)-N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)phenyl]prop-2-enamide

Catalog ID
STK173723
SMILES O=C(Nc1cccc(c1)c1nc2c(o1)c(C)cc(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 C24H18ClN3O4 MW 447.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18ClN3O4/c1-14-10-15(2)23-20(11-14)27-24(32-23)17-4-3-5-18(13-17)26-22(29)9-7-16-6-8-19(25)21(12-16)28(30)31/h3-13H,1-2H3,(H,26,29)/b9-7+
InChIKey
OAIUUKZXDVHHPC-VQHVLOKHSA-N
Synonyms

(2E)3(4CHLORO3NITROPHENYL)N(3(57DIMETHYL13BENZOXAZOL2YL)PHENYL)PROP2ENAMIDE
(E)3(4CHLORO3NITROPHENYL)N(3(57DIMETHYL13BENZOXAZOL2YL)PHENYL)PROP2ENAMIDE
CC1=CC(=C2C(=C1)N=C(O2)C3=CC(=CC=C3)NC(=O)C=CC4=CC(=C(C=C4)Cl)(N+)(=O)(O))C
InChI=1SC24H18ClN3O4c1141015(2)2320(1114)2724(3223)1743518(1317)2622(29)97166819(25)21(1216)28(30)31h313H12H3(H2629)b97+
MFCD03141475
O=C(Nc1cccc(c1)c1nc2c(o1)c(C)cc(c2)C)C=Cc1ccc(c(c1)(N+)(=O)(O))Cl
ZINC000003770783
ZINC03770783
ZINC3770783

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Available files

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