Vitas-M small molecule compound
4-{[(1E,2Z)-2-chloro-3-phenylprop-2-en-1-ylidene]amino}-5-cyclohexyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK576318
SMILES Cl/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 C17H19ClN4S MW 346.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19ClN4S/c18-15(11-13-7-3-1-4-8-13)12-19-22-16(20-21-17(22)23)14-9-5-2-6-10-14/h1,3-4,7-8,11-12,14H,2,5-6,9-10H2,(H,21,23)/b15-11-,19-12+InChIKey
URVLMQHGANREAC-CTGWRUSHSA-NSynonyms
4(((1E2Z)2chloro3phenylprop2en1ylidene)amino)5cyclohexyl24dihydro3H124triazole3thione
4((E)((Z)2CHLORO3PHENYLPROP2ENYLIDENE)AMINO)3CYCLOHEXYL1H124TRIAZOLE5THIONE
ClC(=Cc1ccccc1)C=Nn1c(n(nH)c1=S)C1CCCCC1
InChI=1SC17H19ClN4Sc1815(11137314813)12192216(202117(22)23)1495261014h13478111214H256910H2(H2123)b15111912+
MFCD07206012
ZINC000006227982
ZINC2340723
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