Vitas-M small molecule compound

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

Catalog ID
STL040509
SMILES COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)N/N=C/c1ccc(cc1)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/c1-39-27-17-9-24(10-18-27)30-35-36-31(37(30)26-13-11-25(32)12-14-26)41-21-29(38)34-33-19-22-7-15-28(16-8-22)40-20-23-5-3-2-4-6-23/h2-19H,20-21H2,1H3,(H,34,38)/b33-19+
InChIKey
QMLUGJDNSLJGPZ-HNSNBQBZSA-N
Synonyms

(E)N(4(benzyloxy)benzylidene)2((4(4chlorophenyl)5(4methoxyphenyl)4H124triazol3yl)thio)acetohydrazide
2((4(4CHLOROPHENYL)5(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)N((E)(4PHENYLMETHOXYPHENYL)METHYLIDENEAMINO)ACETAMIDE
COC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NN=CC4=CC=C(C=C4)OCC5=CC=CC=C5
COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)NN=Cc1ccc(cc1)OCc1ccccc1
InChI=1SC31H26ClN5O3Sc1392717924(101827)30353631(37(30)26131125(32)121426)412129(38)3433192271528(16822)4020235324623h219H2021H21H3(H3438)b3319+
MFCD03683152
N((E)(4(benzyloxy)phenyl)methylidene)2((4(4chlorophenyl)5(4methoxyphenyl)4H124triazol3yl)sulfanyl)acetohydrazide
ZINC000001817639
ZINC100858377

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Available files

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