Vitas-M small molecule compound
2-{[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(E)-(3-methylthiophen-2-yl)methylidene]acetohydrazide
Catalog ID
STK078273
SMILES O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C)N/N=C/c1sccc1C
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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 C26H27N5OS2 MW 489.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5OS2/c1-18-14-15-33-22(18)16-27-28-23(32)17-34-25-30-29-24(31(25)21-8-6-5-7-9-21)19-10-12-20(13-11-19)26(2,3)4/h5-16H,17H2,1-4H3,(H,28,32)/b27-16+InChIKey
NMVRSDPQKUPHRD-JVWAILMASA-NSynonyms
361476-59-7(E)2((5(4(tertbutyl)phenyl)4phenyl4H124triazol3yl)thio)N((3methylthiophen2yl)methylene)acetohydrazide
2((5(4tertbutylphenyl)4phenyl124triazol3yl)sulfanyl)N((E)(3methylthiophen2yl)methylideneamino)acetamide
2((5(4TERTBUTYLPHENYL)4PHENYL4H124TRIAZOL3YL)SULFANYL)N((E)(3METHYLTHIOPHEN2YL)METHYLIDENE)ACETOHYDRAZIDE
361476597
CC1=C(SC=C1)C=NNC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC26H27N5OS2c11814153322(18)16272823(32)173425302924(31(25)218657921)19101220(131119)26(23)4h516H17H214H3(H2832)b2716+
MFCD02641838
O=C(CSc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C)NN=Cc1sccc1C
STK078273
ZINC000002699696
ZINC33766750
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