Vitas-M small molecule compound

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

Catalog ID
STK077449
SMILES O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C)N/N=C/c1ccc(cc1)N(C)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 C27H28N6OS MW 484.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N6OS/c1-19-5-11-22(12-6-19)26-30-31-27(33(26)24-13-7-20(2)8-14-24)35-18-25(34)29-28-17-21-9-15-23(16-10-21)32(3)4/h5-17H,18H2,1-4H3,(H,29,34)/b28-17+
InChIKey
DSGPWSYCPWAFMG-OGLMXYFKSA-N
Synonyms
497230-99-6
(E)2((45diptolyl4H124triazol3yl)thio)N(4(dimethylamino)benzylidene)acetohydrazide
2((45bis(4methylphenyl)124triazol3yl)sulfanyl)N((E)(4(dimethylamino)phenyl)methylideneamino)acetamide
2((45BIS(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N((E)(4DIMETHYLAMINOPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((45BIS(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)N((E)(4(DIMETHYLAMINO)PHENYL)METHYLIDENE)ACETOHYDRAZIDE
497230996
CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)C)SCC(=O)NN=CC4=CC=C(C=C4)N(C)C
InChI=1SC27H28N6OSc11951122(12619)26303127(33(26)2413720(2)81424)351825(34)2928172191523(161021)32(3)4h517H18H214H3(H2934)b2817+
MFCD03221268
N((1E)2(4(DIMETHYLAMINO)PHENYL)1AZAVINYL)2(45BIS(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C)NN=Cc1ccc(cc1)N(C)C
STK077449
ZINC000001813868
ZINC33344865

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Available files

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