Vitas-M small molecule compound
4-({(E)-[3-methyl-1-(naphthalen-1-yl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)phenyl thiocyanate
Catalog ID
STL295849
SMILES N#CSc1ccc(cc1)N/C=C/1\C(=NN(C1=O)c1cccc2c1cccc2)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 C22H16N4OS MW 384.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N4OS/c1-15-20(13-24-17-9-11-18(12-10-17)28-14-23)22(27)26(25-15)21-8-4-6-16-5-2-3-7-19(16)21/h2-13,24H,1H3/b20-13+InChIKey
IBNLENHQXKNZHJ-DEDYPNTBSA-NSynonyms
(4(((E)(3methyl1naphthalen1yl5oxopyrazol4ylidene)methyl)amino)phenyl)thiocyanate
4(((E)(3methyl1(naphthalen1yl)5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)phenylthiocyanate
CC1=NN(C(=O)C1=CNC2=CC=C(C=C2)SC#N)C3=CC=CC4=CC=CC=C43
InChI=1SC22H16N4OSc11520(13241791118(121017)281423)22(27)26(2515)2184616523719(16)21h21324H1H3b2013+
MFCD28033188
N#CSc1ccc(cc1)NC=C1C(=NN(C1=O)c1cccc2c1cccc2)C
ZINC000101128516
ZINC101128516
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