Vitas-M small molecule compound
N-[2-(3-chloro-4-methoxyphenyl)-1,3-benzoxazol-5-yl]-2-methyl-3-nitrobenzamide
Catalog ID
STK181146
SMILES COc1ccc(cc1Cl)c1oc2c(n1)cc(cc2)NC(=O)c1cccc(c1C)[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 C22H16ClN3O5 MW 437.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16ClN3O5/c1-12-15(4-3-5-18(12)26(28)29)21(27)24-14-7-9-20-17(11-14)25-22(31-20)13-6-8-19(30-2)16(23)10-13/h3-11H,1-2H3,(H,24,27)InChIKey
NQSJIVKTTFFCTR-UHFFFAOYSA-NSynonyms
CC1=C(C=CC=C1(N+)(=O)(O))C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC(=C(C=C4)OC)Cl
COc1ccc(cc1Cl)c1oc2c(n1)cc(cc2)NC(=O)c1cccc(c1C)(N+)(=O)(O)
InChI=1SC22H16ClN3O5c11215(43518(12)26(28)29)21(27)2414792017(1114)2522(3120)136819(302)16(23)1013h311H12H3(H2427)
MFCD03134735
N(2(3CHLORO4METHOXYPHENYL)13BENZOXAZOL5YL)2METHYL3NITROBENZAMIDE
ZINC000001207299
ZINC01207299
ZINC1207299
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