Vitas-M small molecule compound

5-(4-chlorophenyl)-4-{[(1E,2E)-3-(furan-2-yl)-2-methylprop-2-en-1-ylidene]amino}-4H-1,2,4-triazole-3-thiol

Catalog ID
STK105872
SMILES C/C(=C\c1ccco1)/C=N/n1c(S)nnc1c1ccc(cc1)Cl

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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 C16H13ClN4OS MW 344.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClN4OS/c1-11(9-14-3-2-8-22-14)10-18-21-15(19-20-16(21)23)12-4-6-13(17)7-5-12/h2-10H,1H3,(H,20,23)/b11-9+,18-10+
InChIKey
KZFXDCIAPZVLPN-SLCIPMMZSA-N
Synonyms
380455-44-7
3(4chlorophenyl)4((E)((E)3(furan2yl)2methylprop2enylidene)amino)1H124triazole5thione
4((1E3E)4(2FURYL)3METHYL1AZABUTA13DIENYL)5(4CHLOROPHENYL)124TRIAZOLE3THIOL
5(4CHLOROPHENYL)4(((1E2E)3(FURAN2YL)2METHYLPROP2EN1YLIDENE)AMINO)24DIHYDRO3H124TRIAZOLE3THIONE
5(4CHLOROPHENYL)4(((1E2E)3(FURAN2YL)2METHYLPROP2EN1YLIDENE)AMINO)4H124TRIAZOLE3THIOL
5(4chlorophenyl)4((E)((E)3(furan2yl)2methylallylidene)amino)4H124triazole3thiol
5(4CHLOROPHENYL)4((E)3FURAN2YL2METHYLPROP2EN(E)YLIDENEAMINO)4H(124)TRIAZOLE3THIOL
CC(=CC1=CC=CO1)C=NN2C(=NNC2=S)C3=CC=C(C=C3)Cl
CC(=Cc1ccco1)C=Nn1c(S)nnc1c1ccc(cc1)Cl
InChI=1SC16H13ClN4OSc111(9143282214)10182115(192016(21)23)124613(17)7512h210H1H3(H2023)b119+1810+
MFCD01132121
ZINC15979187

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Available files

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