Vitas-M small molecule compound

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

Catalog ID
STL146285
SMILES O=C(CSc1nnc(n1C1CCCCC1)c1ccc(cc1)C)N/N=C/c1cccc(c1)F

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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 C24H26FN5OS MW 451.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26FN5OS/c1-17-10-12-19(13-11-17)23-28-29-24(30(23)21-8-3-2-4-9-21)32-16-22(31)27-26-15-18-6-5-7-20(25)14-18/h5-7,10-15,21H,2-4,8-9,16H2,1H3,(H,27,31)/b26-15+
InChIKey
HPSMIFGCEDZSGA-CVKSISIWSA-N
Synonyms
497169-92-3
(E)2((4cyclohexyl5(ptolyl)4H124triazol3yl)thio)N(3fluorobenzylidene)acetohydrazide
2((4cyclohexyl5(4methylphenyl)124triazol3yl)sulfanyl)N((E)(3fluorophenyl)methylideneamino)acetamide
2((4cyclohexyl5(4methylphenyl)4H124triazol3yl)sulfanyl)N((E)(3fluorophenyl)methylidene)acetohydrazide
497169923
CC1=CC=C(C=C1)C2=NN=C(N2C3CCCCC3)SCC(=O)NN=CC4=CC(=CC=C4)F
InChI=1SC24H26FN5OSc117101219(131117)23282924(30(23)218324921)321622(31)2726151865720(25)1418h57101521H248916H21H3(H2731)b2615+
MFCD03222527
N((1E)2(3FLUOROPHENYL)1AZAVINYL)2(4CYCLOHEXYL5(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
O=C(CSc1nnc(n1C1CCCCC1)c1ccc(cc1)C)NN=Cc1cccc(c1)F
ZINC000002697599
ZINC33745512

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Available files

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