Vitas-M small molecule compound
(2E)-N-methyl-2-{[1-(3-nitrophenyl)-1H-pyrrol-2-yl]methylidene}hydrazinecarbothioamide
Catalog ID
STL418806
SMILES CNC(=S)N/N=C/c1cccn1c1cccc(c1)[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 C13H13N5O2S MW 303.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N5O2S/c1-14-13(21)16-15-9-12-6-3-7-17(12)10-4-2-5-11(8-10)18(19)20/h2-9H,1H3,(H2,14,16,21)/b15-9+InChIKey
FSOQXGVUHZVKLW-OQLLNIDSSA-NSynonyms
(2E)Nmethyl2((1(3nitrophenyl)1Hpyrrol2yl)methylidene)hydrazinecarbothioamide
1methyl3((E)(1(3nitrophenyl)pyrrol2yl)methylideneamino)thiourea
CNC(=S)NN=CC1=CC=CN1C2=CC(=CC=C2)(N+)(=O)(O)
CNC(=S)NN=Cc1cccn1c1cccc(c1)(N+)(=O)(O)
InChI=1SC13H13N5O2Sc11413(21)161591263717(12)1042511(810)18(19)20h29H1H3(H2141621)b159+
MFCD02951757
ZINC000001005416
ZINC33291595
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