Vitas-M small molecule compound
(2E)-N-benzyl-2-{5-chloro-2-[2-(3-ethyl-5-methylphenoxy)ethoxy]benzylidene}hydrazinecarbothioamide
Catalog ID
STK068659
SMILES CCc1cc(OCCOc2ccc(cc2/C=N/NC(=S)NCc2ccccc2)Cl)cc(c1)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 C26H28ClN3O2S MW 482.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28ClN3O2S/c1-3-20-13-19(2)14-24(15-20)31-11-12-32-25-10-9-23(27)16-22(25)18-29-30-26(33)28-17-21-7-5-4-6-8-21/h4-10,13-16,18H,3,11-12,17H2,1-2H3,(H2,28,30,33)/b29-18+InChIKey
NSLUYUMEVGLDOJ-RDRPBHBLSA-NSynonyms
(2E)NBENZYL2(5CHLORO2(2(3ETHYL5METHYLPHENOXY)ETHOXY)BENZYLIDENE)HYDRAZINECARBOTHIOAMIDE
1benzyl3((E)(5chloro2(2(3ethyl5methylphenoxy)ethoxy)phenyl)methylideneamino)thiourea
CCC1=CC(=CC(=C1)C)OCCOC2=C(C=C(C=C2)Cl)C=NNC(=S)NCC3=CC=CC=C3
CCc1cc(OCCOc2ccc(cc2C=NNC(=S)NCc2ccccc2)Cl)cc(c1)C
InChI=1SC26H28ClN3O2Sc13201319(2)1424(1520)311112322510923(27)1622(25)18293026(33)2817217546821h410131618H3111217H212H3(H2283033)b2918+
MFCD02206727
STK068659
ZINC000009554040
ZINC33728993
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