Vitas-M small molecule compound
5-cyclohexyl-4-{[(E)-(3-methoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STL037960
SMILES COc1cccc(c1)/C=N/n1c(=S)[nH]nc1C1CCCCC1
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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 C16H20N4OS MW 316.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4OS/c1-21-14-9-5-6-12(10-14)11-17-20-15(18-19-16(20)22)13-7-3-2-4-8-13/h5-6,9-11,13H,2-4,7-8H2,1H3,(H,19,22)/b17-11+InChIKey
YSKGZGCSCUCBQS-GZTJUZNOSA-NSynonyms
488103-04-43CYCLOHEXYL4((E)(3METHOXYPHENYL)METHYLIDENEAMINO)1H124TRIAZOLE5THIONE
488103044
5cyclohexyl4(((E)(3methoxyphenyl)methylidene)amino)24dihydro3H124triazole3thione
COC1=CC=CC(=C1)C=NN2C(=NNC2=S)C3CCCCC3
COc1cccc(c1)C=Nn1c(=S)(nH)nc1C1CCCCC1
InChI=1SC16H20N4OSc1211495612(1014)11172015(181916(20)22)137324813h5691113H2478H21H3(H1922)b1711+
MFCD03797273
ZINC000005880421
ZINC01297569
ZINC1297569
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