Vitas-M small molecule compound
4-{[(1E,2E)-3-(furan-2-yl)-2-methylprop-2-en-1-ylidene]amino}-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK568844
SMILES C/C(=C\c1ccco1)/C=N/n1c(S)nnc1c1[nH]nc2c1CCC2
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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 C16H16N6OS MW 340.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N6OS/c1-10(8-11-4-3-7-23-11)9-17-22-15(20-21-16(22)24)14-12-5-2-6-13(12)18-19-14/h3-4,7-9H,2,5-6H2,1H3,(H,18,19)(H,21,24)/b10-8+,17-9+InChIKey
HIYUBIUYIOWMLI-CCLXQDPASA-NSynonyms
4(((1E2E)3(furan2yl)2methylprop2en1ylidene)amino)5(2456tetrahydrocyclopenta(c)pyrazol3yl)4H124triazole3thiol
4((1E3E)4(2FURYL)3METHYL1AZABUTA13DIENYL)5(456TRIHYDROCYCLOPENTA(21D)PYRAZOL3YL)124TRIAZOLE3THIOL
4((E)((E)3(furan2yl)2methylallylidene)amino)5(1456tetrahydrocyclopenta(c)pyrazol3yl)4H124triazole3thiol
4((E)((E)3(furan2yl)2methylprop2enylidene)amino)3(1456tetrahydrocyclopenta(c)pyrazol3yl)1H124triazole5thione
CC(=CC1=CC=CO1)C=NN2C(=NNC2=S)C3=NNC4=C3CCC4
CC(=Cc1ccco1)C=Nn1c(S)nnc1c1(nH)nc2c1CCC2
CC(=Cc1ccco1)C=Nn1c(S)nnc1c1n(nH)c2c1CCC2
InChI=1SC16H16N6OSc110(8114372311)9172215(202116(22)24)141252613(12)181914h3479H256H21H3(H1819)(H2124)b108+179+
MFCD05735158
ZINC000009411253
ZINC33332441
Check stock
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Check stock on Vitas-MAvailable files
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