Vitas-M small molecule compound

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

Catalog ID
STK104812
SMILES O=C(CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)C)N/N=C/C=C/c1ccccc1

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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 C26H22ClN5OS MW 488.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22ClN5OS/c1-19-9-11-21(12-10-19)25-30-31-26(32(25)23-15-13-22(27)14-16-23)34-18-24(33)29-28-17-5-8-20-6-3-2-4-7-20/h2-17H,18H2,1H3,(H,29,33)/b8-5+,28-17+
InChIKey
BQCYEWHLIZBMGD-AZDFISSRSA-N
Synonyms
497950-46-6
(E)2((4(4chlorophenyl)5(ptolyl)4H124triazol3yl)thio)N((E)3phenylallylidene)acetohydrazide
2((4(4CHLOROPHENYL)5(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N((E)((E)3PHENYLPROP2ENYLIDENE)AMINO)ACETAMIDE
2((4(4CHLOROPHENYL)5(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)N((1E2E)3PHENYLPROP2EN1YLIDENE)ACETOHYDRAZIDE
497950466
CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NN=CC=CC4=CC=CC=C4
InChI=1SC26H22ClN5OSc11991121(121019)25303126(32(25)23151322(27)141623)341824(33)29281758206324720h217H18H21H3(H2933)b85+2817+
MFCD03220177
N((1E3E)4PHENYL1AZABUTA13DIENYL)2(4(4CHLOROPHENYL)5(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
O=C(CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)C)NN=CC=Cc1ccccc1
ZINC000001904157
ZINC38169986

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Available files

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