Vitas-M small molecule compound
N'-{(E)-[3-(benzyloxy)phenyl]methylidene}-2-{[4-phenyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Catalog ID
STK094884
SMILES COc1cc(cc(c1OC)OC)c1nnc(n1c1ccccc1)SCC(=O)N/N=C/c1cccc(c1)OCc1ccccc1
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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 C33H31N5O5S MW 609.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H31N5O5S/c1-40-28-18-25(19-29(41-2)31(28)42-3)32-36-37-33(38(32)26-14-8-5-9-15-26)44-22-30(39)35-34-20-24-13-10-16-27(17-24)43-21-23-11-6-4-7-12-23/h4-20H,21-22H2,1-3H3,(H,35,39)/b34-20+InChIKey
FCLUBKZREPSQSH-QXUDOOCXSA-NSynonyms
(E)N(3(benzyloxy)benzylidene)2((4phenyl5(345trimethoxyphenyl)4H124triazol3yl)thio)acetohydrazide
COC1=CC(=CC(=C1OC)OC)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)NN=CC4=CC(=CC=C4)OCC5=CC=CC=C5
COc1cc(cc(c1OC)OC)c1nnc(n1c1ccccc1)SCC(=O)NN=Cc1cccc(c1)OCc1ccccc1
InChI=1SC33H31N5O5Sc140281825(1929(412)31(28)423)32363733(38(32)26148591526)442230(39)3534202413101627(1724)432123116471223h420H2122H213H3(H3539)b3420+
MFCD02075142
N((E)(3(BENZYLOXY)PHENYL)METHYLIDENE)2((4PHENYL5(345TRIMETHOXYPHENYL)4H124TRIAZOL3YL)SULFANYL)ACETOHYDRAZIDE
N((E)(3phenylmethoxyphenyl)methylideneamino)2((4phenyl5(345trimethoxyphenyl)124triazol3yl)sulfanyl)acetamide
STK094884
ZINC000100613913
ZINC101497163
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