Vitas-M small molecule compound

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

Catalog ID
STK048106
SMILES CCCCCOc1ccc(cc1)/C=N/NC(=O)CSc1nnc(n1C1CCCCC1)c1ccc(cc1)Cl

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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 C28H34ClN5O2S MW 540.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34ClN5O2S/c1-2-3-7-18-36-25-16-10-21(11-17-25)19-30-31-26(35)20-37-28-33-32-27(22-12-14-23(29)15-13-22)34(28)24-8-5-4-6-9-24/h10-17,19,24H,2-9,18,20H2,1H3,(H,31,35)/b30-19+
InChIKey
SFPWHBYPGZFKMZ-NDZAJKAJSA-N
Synonyms
488130-09-2
(E)2((5(4chlorophenyl)4cyclohexyl4H124triazol3yl)thio)N(4(pentyloxy)benzylidene)acetohydrazide
2((5(4chlorophenyl)4cyclohexyl124triazol3yl)sulfanyl)N((E)(4pentoxyphenyl)methylideneamino)acetamide
2((5(4CHLOROPHENYL)4CYCLOHEXYL4H124TRIAZOL3YL)SULFANYL)N((E)(4(PENTYLOXY)PHENYL)METHYLIDENE)ACETOHYDRAZIDE
488130092
CCCCCOC1=CC=C(C=C1)C=NNC(=O)CSC2=NN=C(N2C3CCCCC3)C4=CC=C(C=C4)Cl
CCCCCOc1ccc(cc1)C=NNC(=O)CSc1nnc(n1C1CCCCC1)c1ccc(cc1)Cl
InChI=1SC28H34ClN5O2Sc1237183625161021(111725)19303126(35)203728333227(22121423(29)151322)34(28)248546924h10171924H291820H21H3(H3135)b3019+
MFCD03220955
N((1E)2(4PENTYLOXYPHENYL)1AZAVINYL)2(5(4CHLOROPHENYL)4CYCLOHEXYL(124TRIAZOL3YLTHIO))ACETAMIDE
STK048106
ZINC000100839074
ZINC101437866

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Available files

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