Vitas-M small molecule compound
3-[({(2E)-2-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methylidene]hydrazinyl}carbonothioyl)amino]benzoic acid
Catalog ID
STK965520
SMILES CCn1nc(c(c1C)/C=N/NC(=S)Nc1cccc(c1)C(=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 C16H19N5O2S MW 345.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N5O2S/c1-4-21-11(3)14(10(2)20-21)9-17-19-16(24)18-13-7-5-6-12(8-13)15(22)23/h5-9H,4H2,1-3H3,(H,22,23)(H2,18,19,24)/b17-9+InChIKey
CUGIYCZRCFHDFH-RQZCQDPDSA-NSynonyms
1005575-48-31005575483
3(((((1E)2(1ETHYL35DIMETHYLPYRAZOL4YL)1AZAVINYL)AMINO)THIOXOMETHYL)AMINO)BENZOICACID
3((((2E)2((1ethyl35dimethyl1Hpyrazol4yl)methylidene)hydrazinyl)carbonothioyl)amino)benzoicacid
3(((E)(1ethyl35dimethylpyrazol4yl)methylideneamino)carbamothioylamino)benzoicacid
CCN1C(=C(C(=N1)C)C=NNC(=S)NC2=CC=CC(=C2)C(=O)O)C
CCn1nc(c(c1C)C=NNC(=S)Nc1cccc(c1)C(=O)O)C
InChI=1SC16H19N5O2Sc142111(3)14(10(2)2021)9171916(24)181375612(813)15(22)23h59H4H213H3(H2223)(H2181924)b179+
MFCD04045283
ZINC000002743402
ZINC35656689
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