Vitas-M small molecule compound
2-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK761801
SMILES COc1cc(ccc1OC)/C=N/n1nc[nH]c1=S
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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 C11H12N4O2S MW 264.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H12N4O2S/c1-16-9-4-3-8(5-10(9)17-2)6-13-15-11(18)12-7-14-15/h3-7H,1-2H3,(H,12,14,18)/b13-6+InChIKey
MQVXGIBZIBQKAH-AWNIVKPZSA-NSynonyms
2(((E)(34DIMETHOXYPHENYL)METHYLIDENE)AMINO)24DIHYDRO3H124TRIAZOLE3THIONE
2((E)(34DIMETHOXYPHENYL)METHYLIDENEAMINO)1H124TRIAZOLE3THIONE
COC1=C(C=C(C=C1)C=NN2C(=S)N=CN2)OC
COc1cc(ccc1OC)C=Nn1nc(nH)c1=S
InChI=1SC11H12N4O2Sc1169438(510(9)172)6131511(18)1271415h37H12H3(H121418)b136+
MFCD01871113
ZINC000005729810
ZINC33285883
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