Vitas-M small molecule compound

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

Catalog ID
STK065762
SMILES O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C)N/N=C(/c1ccc2c(c1)cccc2)\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 C30H27N5OS MW 505.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N5OS/c1-20-8-12-24(13-9-20)29-33-34-30(35(29)27-16-10-21(2)11-17-27)37-19-28(36)32-31-22(3)25-15-14-23-6-4-5-7-26(23)18-25/h4-18H,19H2,1-3H3,(H,32,36)/b31-22+
InChIKey
MAFLYVYHKHHGKG-DFKUXCBWSA-N
Synonyms

(Z)2((45diptolyl4H124triazol3yl)thio)N(1(naphthalen2yl)ethylidene)acetohydrazide
2((45bis(4methylphenyl)124triazol3yl)sulfanyl)N((E)1naphthalen2ylethylideneamino)acetamide
2((45BIS(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)N((1E)1(NAPHTHALEN2YL)ETHYLIDENE)ACETOHYDRAZIDE
CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)C)SCC(=O)NN=C(C)C4=CC5=CC=CC=C5C=C4
InChI=1SC30H27N5OSc12081224(13920)29333430(35(29)27161021(2)111727)371928(36)323122(3)25151423645726(23)1825h418H19H213H3(H3236)b3122+
MFCD02729623
N((1E)2(2NAPHTHYL)1AZAPROP1ENYL)2(45BIS(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C)NN=C(c1ccc2c(c1)cccc2)C
STK065762
ZINC000013897771
ZINC09019528
ZINC9019528

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.