Vitas-M small molecule compound
4-[(E)-(2-carbamothioylhydrazinylidene)methyl]phenyl 4-methyl-3-nitrobenzenesulfonate
Catalog ID
STK380338
SMILES NC(=S)N/N=C/c1ccc(cc1)OS(=O)(=O)c1ccc(c(c1)[N+](=O)[O-])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 C15H14N4O5S2 MW 394.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14N4O5S2/c1-10-2-7-13(8-14(10)19(20)21)26(22,23)24-12-5-3-11(4-6-12)9-17-18-15(16)25/h2-9H,1H3,(H3,16,18,25)/b17-9+InChIKey
QYIWEKDGRUZCKK-RQZCQDPDSA-NSynonyms
(4((E)(carbamothioylhydrazinylidene)methyl)phenyl)4methyl3nitrobenzenesulfonate
4((E)(2carbamothioylhydrazinylidene)methyl)phenyl4methyl3nitrobenzenesulfonate
CC1=C(C=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)C=NNC(=S)N)(N+)(=O)(O)
InChI=1SC15H14N4O5S2c1102713(814(10)19(20)21)26(2223)24125311(4612)9171815(16)25h29H1H3(H3161825)b179+
MFCD03103648
NC(=S)NN=Cc1ccc(cc1)OS(=O)(=O)c1ccc(c(c1)(N+)(=O)(O))C
ZINC000008861529
ZINC33738646
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