Vitas-M small molecule compound
(2E)-2-[3-ethoxy-4-(1-phenylethoxy)benzylidene]-N-(prop-2-en-1-yl)hydrazinecarbothioamide
Catalog ID
STK385615
SMILES C=CCNC(=S)N/N=C/c1ccc(c(c1)OCC)OC(c1ccccc1)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 C21H25N3O2S MW 383.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3O2S/c1-4-13-22-21(27)24-23-15-17-11-12-19(20(14-17)25-5-2)26-16(3)18-9-7-6-8-10-18/h4,6-12,14-16H,1,5,13H2,2-3H3,(H2,22,24,27)/b23-15+InChIKey
DMQCERXWUKWVLJ-HZHRSRAPSA-NSynonyms
(((1E)2(3ETHOXY4(PHENYLETHOXY)PHENYL)1AZAVINYL)AMINO)(PROP2ENYLAMINO)METHANE1THIONE
(2E)2(3ETHOXY4(1PHENYLETHOXY)BENZYLIDENE)N(PROP2EN1YL)HYDRAZINECARBOTHIOAMIDE
1((E)(3ethoxy4(1phenylethoxy)phenyl)methylideneamino)3prop2enylthiourea
C=CCNC(=S)NN=Cc1ccc(c(c1)OCC)OC(c1ccccc1)C
CCOC1=C(C=CC(=C1)C=NNC(=S)NCC=C)OC(C)C2=CC=CC=C2
InChI=1SC21H25N3O2Sc14132221(27)24231517111219(20(1417)2552)2616(3)1897681018h46121416H1513H223H3(H2222427)b2315+
MFCD02125361
ZINC000004511319
ZINC000004511333
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