Vitas-M small molecule compound

5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-(4-nitrophenyl)-1,3-oxazole-4-carbonitrile

Catalog ID
STK516032
SMILES N#Cc1nc(oc1NCCc1ccc(c(c1)OC)OC)c1ccc(cc1)[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 C20H18N4O5 MW 394.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O5/c1-27-17-8-3-13(11-18(17)28-2)9-10-22-20-16(12-21)23-19(29-20)14-4-6-15(7-5-14)24(25)26/h3-8,11,22H,9-10H2,1-2H3
InChIKey
PFOSDBGBJLPPRG-UHFFFAOYSA-N
Synonyms
879933-11-6
5((2(34dimethoxyphenyl)ethyl)amino)2(4nitrophenyl)13oxazole4carbonitrile
5(2(34dimethoxyphenyl)ethylamino)2(4nitrophenyl)13oxazole4carbonitrile
879933116
COC1=C(C=C(C=C1)CCNC2=C(N=C(O2)C3=CC=C(C=C3)(N+)(=O)(O))C#N)OC
InChI=1SC20H18N4O5c127178313(1118(17)282)910222016(1221)2319(2920)144615(7514)24(25)26h381122H910H212H3
MFCD06645486
N#Cc1nc(oc1NCCc1ccc(c(c1)OC)OC)c1ccc(cc1)(N+)(=O)(O)
ZINC000016742189
ZINC16742189

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Available files

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