Vitas-M small molecule compound

N'-{(E)-[3-(benzyloxy)phenyl]methylidene}-2-{[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide

Catalog ID
STL051675
SMILES COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)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 C31H26ClN5O3S MW 584.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26ClN5O3S/c1-39-27-16-10-24(11-17-27)30-35-36-31(37(30)26-14-12-25(32)13-15-26)41-21-29(38)34-33-19-23-8-5-9-28(18-23)40-20-22-6-3-2-4-7-22/h2-19H,20-21H2,1H3,(H,34,38)/b33-19+
InChIKey
AOYHWKNJZILBAF-HNSNBQBZSA-N
Synonyms

(E)N(3(benzyloxy)benzylidene)2((4(4chlorophenyl)5(4methoxyphenyl)4H124triazol3yl)thio)acetohydrazide
2((4(4CHLOROPHENYL)5(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N((E)(3PHENYLMETHOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NN=CC4=CC(=CC=C4)OCC5=CC=CC=C5
COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)NN=Cc1cccc(c1)OCc1ccccc1
InChI=1SC31H26ClN5O3Sc13927161024(111727)30353631(37(30)26141225(32)131526)412129(38)3433192385928(1823)4020226324722h219H2021H21H3(H3438)b3319+
MFCD02714500
N((1E)2(3(PHENYLMETHOXY)PHENYL)1AZAVINYL)2(4(4CHLOROPHENYL)5(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
N((E)(3(benzyloxy)phenyl)methylidene)2((4(4chlorophenyl)5(4methoxyphenyl)4H124triazol3yl)sulfanyl)acetohydrazide
ZINC000002584108
ZINC103120246

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Available files

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