Vitas-M small molecule compound
N'-[(E)-(2-fluorophenyl)methylidene]-2-{[5-{[(4-methylphenyl)amino]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}propanehydrazide
Catalog ID
STL171391
SMILES C=CCn1c(nnc1CNc1ccc(cc1)C)SC(C(=O)N/N=C/c1ccccc1F)C
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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 C23H25FN6OS MW 452.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25FN6OS/c1-4-13-30-21(15-25-19-11-9-16(2)10-12-19)27-29-23(30)32-17(3)22(31)28-26-14-18-7-5-6-8-20(18)24/h4-12,14,17,25H,1,13,15H2,2-3H3,(H,28,31)/b26-14+InChIKey
VUUVJSJDMAKLDX-VULFUBBASA-NSynonyms
570418-68-72((4ALLYL5(4TOLUIDINOMETHYL)4H124TRIAZOL3YL)SULFANYL)N(2FLUOROBENZYLIDENE)PROPANOHYDRAZIDE
570418687
C=CCn1c(nnc1CNc1ccc(cc1)C)SC(C(=O)NN=Cc1ccccc1F)C
CC1=CC=C(C=C1)NCC2=NN=C(N2CC=C)SC(C)C(=O)NN=CC3=CC=CC=C3F
InChI=1SC23H25FN6OSc14133021(15251911916(2)101219)272923(30)3217(3)22(31)28261418756820(18)24h412141725H11315H223H3(H2831)b2614+
MFCD01614612
N((E)(2fluorophenyl)methylidene)2((5(((4methylphenyl)amino)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)propanehydrazide
N((E)(2fluorophenyl)methylideneamino)2((5((4methylanilino)methyl)4prop2enyl124triazol3yl)sulfanyl)propanamide
ZINC000000654711
ZINC000000654716
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