Vitas-M small molecule compound
(2E)-N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-{[5-(3-nitrophenyl)furan-2-yl]methylidene}hydrazinecarbothioamide
Catalog ID
STK822082
SMILES S=C(NC1CCS(=O)(=O)C1)N/N=C/c1ccc(o1)c1cccc(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 C16H16N4O5S2 MW 408.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O5S2/c21-20(22)13-3-1-2-11(8-13)15-5-4-14(25-15)9-17-19-16(26)18-12-6-7-27(23,24)10-12/h1-5,8-9,12H,6-7,10H2,(H2,18,19,26)/b17-9+InChIKey
PIJAXKCAYLAJHJ-RQZCQDPDSA-NSynonyms
(2E)N(11dioxidotetrahydrothiophen3yl)2((5(3nitrophenyl)furan2yl)methylidene)hydrazinecarbothioamide
1(11dioxothiolan3yl)3((E)(5(3nitrophenyl)furan2yl)methylideneamino)thiourea
C1CS(=O)(=O)CC1NC(=S)NN=CC2=CC=C(O2)C3=CC(=CC=C3)(N+)(=O)(O)
InChI=1SC16H16N4O5S2c2120(22)1331211(813)155414(2515)9171916(26)18126727(2324)1012h158912H6710H2(H2181926)b179+
MFCD01072036
S=C(NC1CCS(=O)(=O)C1)NN=Cc1ccc(o1)c1cccc(c1)(N+)(=O)(O)
ZINC000026967869
ZINC000026967878
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