Vitas-M small molecule compound

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

Catalog ID
STL362366
SMILES O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)Cl)N/N=C/c1cccc2c1cccc2

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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 C28H22ClN5OS MW 512.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22ClN5OS/c1-19-9-15-24(16-10-19)34-27(21-11-13-23(29)14-12-21)32-33-28(34)36-18-26(35)31-30-17-22-7-4-6-20-5-2-3-8-25(20)22/h2-17H,18H2,1H3,(H,31,35)/b30-17+
InChIKey
FLSLANGEJKLWAJ-OCSSWDANSA-N
Synonyms
315231-12-0
(E)2((5(4chlorophenyl)4(ptolyl)4H124triazol3yl)thio)N(naphthalen1ylmethylene)acetohydrazide
2((5(4CHLOROPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N((E)NAPHTHALEN1YLMETHYLIDENEAMINO)ACETAMIDE
2((5(4chlorophenyl)4(4methylphenyl)4H124triazol3yl)sulfanyl)N((E)naphthalen1ylmethylidene)acetohydrazide
315231120
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC3=CC=CC4=CC=CC=C43)C5=CC=C(C=C5)Cl
InChI=1SC28H22ClN5OSc11991524(161019)3427(21111323(29)141221)323328(34)361826(35)3130172274620523825(20)22h217H18H21H3(H3135)b3017+
MFCD02077417
N((1E)2NAPHTHYL1AZAVINYL)2(5(4CHLOROPHENYL)4(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)Cl)NN=Cc1cccc2c1cccc2
ZINC000002226890
ZINC33351005

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Available files

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