Vitas-M small molecule compound
N'-[(E)-(3,4-dimethoxyphenyl)methylidene]-2-{[5-{[(4-methylphenyl)amino]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetohydrazide
Catalog ID
STL172495
SMILES C=CCn1c(SCC(=O)N/N=C/c2ccc(c(c2)OC)OC)nnc1CNc1ccc(cc1)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 C24H28N6O3S MW 480.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N6O3S/c1-5-12-30-22(15-25-19-9-6-17(2)7-10-19)27-29-24(30)34-16-23(31)28-26-14-18-8-11-20(32-3)21(13-18)33-4/h5-11,13-14,25H,1,12,15-16H2,2-4H3,(H,28,31)/b26-14+InChIKey
IUWNQBWLCXMBPA-VULFUBBASA-NSynonyms
570418-22-3570418223
C=CCn1c(SCC(=O)NN=Cc2ccc(c(c2)OC)OC)nnc1CNc1ccc(cc1)C
CC1=CC=C(C=C1)NCC2=NN=C(N2CC=C)SCC(=O)NN=CC3=CC(=C(C=C3)OC)OC
InChI=1SC24H28N6O3Sc15123022(1525199617(2)71019)272924(30)341623(31)2826141881120(323)21(1318)334h511131425H1121516H224H3(H2831)b2614+
MFCD01437028
N((E)(34dimethoxyphenyl)methylidene)2((5(((4methylphenyl)amino)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetohydrazide
N((E)(34dimethoxyphenyl)methylideneamino)2((5((4methylanilino)methyl)4prop2enyl124triazol3yl)sulfanyl)acetamide
ZINC000008397055
ZINC33768532
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