Vitas-M small molecule compound
(2E)-N-benzyl-2-(5-bromo-2-{2-[5-methyl-2-(propan-2-yl)phenoxy]ethoxy}benzylidene)hydrazinecarbothioamide
Catalog ID
STK085419
SMILES S=C(NCc1ccccc1)N/N=C/c1cc(Br)ccc1OCCOc1cc(C)ccc1C(C)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 C27H30BrN3O2S MW 540.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30BrN3O2S/c1-19(2)24-11-9-20(3)15-26(24)33-14-13-32-25-12-10-23(28)16-22(25)18-30-31-27(34)29-17-21-7-5-4-6-8-21/h4-12,15-16,18-19H,13-14,17H2,1-3H3,(H2,29,31,34)/b30-18+InChIKey
WMMFVBKZFQWVSP-UXHLAJHPSA-NSynonyms
(2E)NBENZYL2(5BROMO2(2(5METHYL2(PROPAN2YL)PHENOXY)ETHOXY)BENZYLIDENE)HYDRAZINECARBOTHIOAMIDE
(E)Nbenzyl2(5bromo2(2(2isopropyl5methylphenoxy)ethoxy)benzylidene)hydrazinecarbothioamide
1BENZYL3((E)(5BROMO2(2(5METHYL2PROPAN2YLPHENOXY)ETHOXY)PHENYL)METHYLIDENEAMINO)THIOUREA
CC1=CC(=C(C=C1)C(C)C)OCCOC2=C(C=C(C=C2)Br)C=NNC(=S)NCC3=CC=CC=C3
InChI=1SC27H30BrN3O2Sc119(2)2411920(3)1526(24)3314133225121023(28)1622(25)18303127(34)2917217546821h41215161819H131417H213H3(H2293134)b3018+
MFCD02985221
S=C(NCc1ccccc1)NN=Cc1cc(Br)ccc1OCCOc1cc(C)ccc1C(C)C
STK085419
ZINC000002323846
ZINC101487868
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