Vitas-M small molecule compound
2-{(E)-[2-(1,1-dioxido-1,2-benzothiazol-3-yl)hydrazinylidene]methyl}phenyl thiocyanate
Catalog ID
STL290893
SMILES N#CSc1ccccc1/C=N/NC1=NS(=O)(=O)c2c1cccc2
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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 C15H10N4O2S2 MW 342.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H10N4O2S2/c16-10-22-13-7-3-1-5-11(13)9-17-18-15-12-6-2-4-8-14(12)23(20,21)19-15/h1-9H,(H,18,19)/b17-9+InChIKey
SEAGIZULWZRAOQ-RQZCQDPDSA-NSynonyms
(2((E)((11dioxo12benzothiazol3yl)hydrazinylidene)methyl)phenyl)thiocyanate
2((E)(2(11dioxido12benzothiazol3yl)hydrazinylidene)methyl)phenylthiocyanate
C1=CC=C(C(=C1)C=NNC2=NS(=O)(=O)C3=CC=CC=C32)SC#N
InChI=1SC15H10N4O2S2c16102213731511(13)917181512624814(12)23(2021)1915h19H(H1819)b179+
MFCD02648648
N#CSc1ccccc1C=NNC1=NS(=O)(=O)c2c1cccc2
ZINC000005770492
ZINC101346979
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