Vitas-M small molecule compound
ethyl 4-(4-{(1E)-1-[2-(methylcarbamothioyl)hydrazinylidene]ethyl}phenyl)butanoate
Catalog ID
STK534863
SMILES CCOC(=O)CCCc1ccc(cc1)/C(=N/NC(=S)NC)/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 C16H23N3O2S MW 321.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23N3O2S/c1-4-21-15(20)7-5-6-13-8-10-14(11-9-13)12(2)18-19-16(22)17-3/h8-11H,4-7H2,1-3H3,(H2,17,19,22)/b18-12+InChIKey
JDMKKOYOYDCFQV-LDADJPATSA-NSynonyms
(E)ethyl4(4(1(2(methylcarbamothioyl)hydrazono)ethyl)phenyl)butanoate
CCOC(=O)CCCC1=CC=C(C=C1)C(=NNC(=S)NC)C
CCOC(=O)CCCc1ccc(cc1)C(=NNC(=S)NC)C
ethyl4(4((1E)1(2(methylcarbamothioyl)hydrazinylidene)ethyl)phenyl)butanoate
ethyl4(4((E)CmethylN(methylcarbamothioylamino)carbonimidoyl)phenyl)butanoate
InChI=1SC16H23N3O2Sc142115(20)7561381014(11913)12(2)181916(22)173h811H47H213H3(H2171922)b1812+
MFCD02987830
ZINC000013635247
ZINC13140587
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