Vitas-M small molecule compound
4-chloro-2-{(E)-[2-(methylcarbamothioyl)hydrazinylidene]methyl}phenyl 4-methylbenzenesulfonate
Catalog ID
STK007749
SMILES CNC(=S)N/N=C/c1cc(Cl)ccc1OS(=O)(=O)c1ccc(cc1)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 C16H16ClN3O3S2 MW 397.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClN3O3S2/c1-11-3-6-14(7-4-11)25(21,22)23-15-8-5-13(17)9-12(15)10-19-20-16(24)18-2/h3-10H,1-2H3,(H2,18,20,24)/b19-10+InChIKey
FBLVBHXRHGLKSD-VXLYETTFSA-NSynonyms
(4CHLORO2((E)(METHYLCARBAMOTHIOYLHYDRAZINYLIDENE)METHYL)PHENYL)4METHYLBENZENESULFONATE
4CHLORO2((E)(2(METHYLCARBAMOTHIOYL)HYDRAZINYLIDENE)METHYL)PHENYL4METHYLBENZENESULFONATE
CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)Cl)C=NNC(=S)NC
CNC(=S)NN=Cc1cc(Cl)ccc1OS(=O)(=O)c1ccc(cc1)C
InChI=1SC16H16ClN3O3S2c1113614(7411)25(2122)23158513(17)912(15)10192016(24)182h310H12H3(H2182024)b1910+
MFCD02126007
STK007749
ZINC000002970176
ZINC33398336
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