Vitas-M small molecule compound

N-{[4-(4-nitrophenyl)piperazin-1-yl]carbonothioyl}-2-phenoxyacetamide

Catalog ID
STK085789
SMILES S=C(N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])NC(=O)COc1ccccc1

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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 C19H20N4O4S MW 400.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4O4S/c24-18(14-27-17-4-2-1-3-5-17)20-19(28)22-12-10-21(11-13-22)15-6-8-16(9-7-15)23(25)26/h1-9H,10-14H2,(H,20,24,28)
InChIKey
BAJAWQSDJHZFAB-UHFFFAOYSA-N
Synonyms

C1CN(CCN1C2=CC=C(C=C2)(N+)(=O)(O))C(=S)NC(=O)COC3=CC=CC=C3
InChI=1SC19H20N4O4Sc2418(1427174213517)2019(28)22121021(111322)156816(9715)23(25)26h19H1014H2(H202428)
MFCD02630980
N((4(4NITROPHENYL)PIPERAZIN1YL)CARBONOTHIOYL)2PHENOXYACETAMIDE
N(4(4NITROPHENYL)PIPERAZINE1CARBOTHIOYL)2PHENOXYACETAMIDE
S=C(N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O))NC(=O)COc1ccccc1
STK085789
ZINC000005243425
ZINC05243425
ZINC5243425

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.