Vitas-M small molecule compound
4-chloro-N-[3-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-nitrobenzamide
Catalog ID
STK163374
SMILES Clc1ccc2c(c1)nc(o2)c1cccc(c1C)NC(=O)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 C21H13Cl2N3O4 MW 442.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H13Cl2N3O4/c1-11-14(21-25-17-10-13(22)6-8-19(17)30-21)3-2-4-16(11)24-20(27)12-5-7-15(23)18(9-12)26(28)29/h2-10H,1H3,(H,24,27)InChIKey
MCHIKDVTCBQICH-UHFFFAOYSA-NSynonyms
4CHLORON(3(5CHLORO13BENZOXAZOL2YL)2METHYLPHENYL)3NITROBENZAMIDE
CC1=C(C=CC=C1NC(=O)C2=CC(=C(C=C2)Cl)(N+)(=O)(O))C3=NC4=C(O3)C=CC(=C4)Cl
Clc1ccc2c(c1)nc(o2)c1cccc(c1C)NC(=O)c1ccc(c(c1)(N+)(=O)(O))Cl
InChI=1SC21H13Cl2N3O4c11114(2125171013(22)6819(17)3021)32416(11)2420(27)125715(23)18(912)26(28)29h210H1H3(H2427)
MFCD03059610
ZINC000009846200
ZINC09846200
ZINC9846200
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