Vitas-M small molecule compound

5-cyclohexyl-4-{[(1E,2E)-2-methyl-3-phenylprop-2-en-1-ylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione

Catalog ID
STK846072
SMILES C/C(=C\c1ccccc1)/C=N/n1c(n[nH]c1=S)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 C18H22N4S MW 326.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4S/c1-14(12-15-8-4-2-5-9-15)13-19-22-17(20-21-18(22)23)16-10-6-3-7-11-16/h2,4-5,8-9,12-13,16H,3,6-7,10-11H2,1H3,(H,21,23)/b14-12+,19-13+
InChIKey
DYJLDAJLALHJNM-QQWZAAIYSA-N
Synonyms
488747-58-6
3CYCLOHEXYL4(((E)2METHYL3PHENYLPROP2ENYLIDENE)AMINO)1H124TRIAZOLE5THIONE
3CYCLOHEXYL4((E)((E)2METHYL3PHENYLPROP2ENYLIDENE)AMINO)1H124TRIAZOLE5THIONE
488747586
5cyclohexyl4(((1E2E)2methyl3phenylprop2en1ylidene)amino)24dihydro3H124triazole3thione
5CYCLOHEXYL4((2METHYL3PHENYL2PROPEN1YLIDENE)AMINO)4H124TRIAZOLE3THIOL
CC(=CC1=CC=CC=C1)C=NN2C(=NNC2=S)C3CCCCC3
CC(=Cc1ccccc1)C=Nn1c(n(nH)c1=S)C1CCCCC1
InChI=1SC18H22N4Sc114(12158425915)13192217(202118(22)23)16106371116h24589121316H3671011H21H3(H2123)b1412+1913+
MFCD03796960
ZINC000006780331
ZINC15979118

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Available files

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