Vitas-M small molecule compound

4-{[(E)-(4-methoxy-3-{[4-(propan-2-yl)phenoxy]methyl}phenyl)methylidene]amino}-4H-1,2,4-triazole-3-thiol

Catalog ID
STK306568
SMILES COc1ccc(cc1COc1ccc(cc1)C(C)C)/C=N/n1cnnc1S

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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 C20H22N4O2S MW 382.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O2S/c1-14(2)16-5-7-18(8-6-16)26-12-17-10-15(4-9-19(17)25-3)11-22-24-13-21-23-20(24)27/h4-11,13-14H,12H2,1-3H3,(H,23,27)/b22-11+
InChIKey
PARJLLJSOUOLKP-SSDVNMTOSA-N
Synonyms
828280-97-3
4(((E)(4methoxy3((4(propan2yl)phenoxy)methyl)phenyl)methylidene)amino)4H124triazole3thiol
4((E)(4methoxy3((4propan2ylphenoxy)methyl)phenyl)methylideneamino)1H124triazole5thione
828280973
CC(C)C1=CC=C(C=C1)OCC2=C(C=CC(=C2)C=NN3C=NNC3=S)OC
COc1ccc(cc1COc1ccc(cc1)C(C)C)C=Nn1cnnc1S
InChI=1SC20H22N4O2Sc114(2)165718(8616)2612171015(4919(17)253)11222413212320(24)27h4111314H12H213H3(H2327)b2211+
MFCD04047896
ZINC000007009520
ZINC2791134

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Available files

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