Vitas-M small molecule compound
1-(4-nitrophenyl)-3-[1-(pentafluorobenzyl)-1H-pyrazol-3-yl]thiourea
Catalog ID
STK304372
SMILES S=C(Nc1ccn(n1)Cc1c(F)c(F)c(c(c1F)F)F)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 C17H10F5N5O2S MW 443.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H10F5N5O2S/c18-12-10(13(19)15(21)16(22)14(12)20)7-26-6-5-11(25-26)24-17(30)23-8-1-3-9(4-2-8)27(28)29/h1-6H,7H2,(H2,23,24,25,30)InChIKey
UDRBBPHYEQVZFZ-UHFFFAOYSA-NSynonyms
894729-55-61(4nitrophenyl)3(1((23456pentafluorophenyl)methyl)pyrazol3yl)thiourea
1(4nitrophenyl)3(1(pentafluorobenzyl)1Hpyrazol3yl)thiourea
894729556
C1=CC(=CC=C1NC(=S)NC2=NN(C=C2)CC3=C(C(=C(C(=C3F)F)F)F)F)(N+)(=O)(O)
InChI=1SC17H10F5N5O2Sc181210(13(19)15(21)16(22)14(12)20)7266511(2526)2417(30)238139(428)27(28)29h16H7H2(H223242530)
MFCD04129460
S=C(Nc1ccn(n1)Cc1c(F)c(F)c(c(c1F)F)F)Nc1ccc(cc1)(N+)(=O)(O)
ZINC000013959148
ZINC13959148
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