Vitas-M small molecule compound
1-[1-(4-chlorobenzyl)-1H-pyrazol-3-yl]-3-(4-nitrophenyl)thiourea
Catalog ID
STK487189
SMILES S=C(Nc1ccn(n1)Cc1ccc(cc1)Cl)Nc1ccc(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 C17H14ClN5O2S MW 387.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14ClN5O2S/c18-13-3-1-12(2-4-13)11-22-10-9-16(21-22)20-17(26)19-14-5-7-15(8-6-14)23(24)25/h1-10H,11H2,(H2,19,20,21,26)InChIKey
NXUUIGCAJOPBLT-UHFFFAOYSA-NSynonyms
((1((4CHLOROPHENYL)METHYL)PYRAZOL3YL)AMINO)((4NITROPHENYL)AMINO)METHANE1THIONE
1(1((4chlorophenyl)methyl)pyrazol3yl)3(4nitrophenyl)thiourea
1(1(4chlorobenzyl)1Hpyrazol3yl)3(4nitrophenyl)thiourea
C1=CC(=CC=C1CN2C=CC(=N2)NC(=S)NC3=CC=C(C=C3)(N+)(=O)(O))Cl
InChI=1SC17H14ClN5O2Sc18133112(2413)112210916(2122)2017(26)19145715(8614)23(24)25h110H11H2(H219202126)
MFCD06174623
S=C(Nc1ccn(n1)Cc1ccc(cc1)Cl)Nc1ccc(cc1)(N+)(=O)(O)
ZINC000013330977
ZINC13330977
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