Vitas-M small molecule compound
4-ethyl-5-(thiophen-2-yl)-2-(9H-xanthen-9-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK664515
SMILES CCn1c(nn(c1=S)C1c2ccccc2Oc2c1cccc2)c1cccs1
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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 C21H17N3OS2 MW 391.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3OS2/c1-2-23-20(18-12-7-13-27-18)22-24(21(23)26)19-14-8-3-5-10-16(14)25-17-11-6-4-9-15(17)19/h3-13,19H,2H2,1H3InChIKey
SZMYJMZODWVYDN-UHFFFAOYSA-NSynonyms
(124)TRIAZOLE3THIONE4ETHYL5(THIOPHEN2YL)2(9HXANTHEN9YL)24DIHYDRO
4ethyl5(thiophen2yl)2(9Hxanthen9yl)24dihydro3H124triazole3thione
4ETHYL5THIOPHEN2YL2(9HXANTHEN9YL)124TRIAZOLE3THIONE
CCN1C(=NN(C1=S)C2C3=CC=CC=C3OC4=CC=CC=C24)C5=CC=CS5
InChI=1SC21H17N3OS2c122320(18127132718)2224(21(23)26)19148351016(14)25171164915(17)19h31319H2H21H3
MFCD05855218
ZINC000004694515
ZINC04694515
ZINC4694515
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