Vitas-M small molecule compound
2,3-dichloro-4-({(Z)-[1-(4-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)phenyl thiocyanate
Catalog ID
STL359591
SMILES N#CSc1ccc(c(c1Cl)Cl)N/C=C\1/C(=NN(C1=O)c1ccc(cc1)Cl)C
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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 C18H11Cl3N4OS MW 437.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11Cl3N4OS/c1-10-13(18(26)25(24-10)12-4-2-11(19)3-5-12)8-23-14-6-7-15(27-9-22)17(21)16(14)20/h2-8,23H,1H3/b13-8-InChIKey
HEXRFSHDNWGILJ-JYRVWZFOSA-NSynonyms
(23dichloro4(((Z)(1(4chlorophenyl)3methyl5oxopyrazol4ylidene)methyl)amino)phenyl)thiocyanate
23dichloro4(((Z)(1(4chlorophenyl)3methyl5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)phenylthiocyanate
CC1=NN(C(=O)C1=CNC2=C(C(=C(C=C2)SC#N)Cl)Cl)C3=CC=C(C=C3)Cl
InChI=1SC18H11Cl3N4OSc11013(18(26)25(2410)124211(19)3512)823146715(27922)17(21)16(14)20h2823H1H3b138
MFCD28033767
N#CSc1ccc(c(c1Cl)Cl)NC=C1C(=NN(C1=O)c1ccc(cc1)Cl)C
ZINC000101346595
ZINC101346595
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