Vitas-M small molecule compound
4-{[(E)-thiophen-2-ylmethylidene]amino}-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK600064
SMILES COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/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 C16H16N4O3S2 MW 376.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O3S2/c1-21-12-7-10(8-13(22-2)14(12)23-3)15-18-19-16(24)20(15)17-9-11-5-4-6-25-11/h4-9H,1-3H3,(H,19,24)/b17-9+InChIKey
RNPQYUIDFZCYJP-RQZCQDPDSA-NSynonyms
499118-31-94(((E)thiophen2ylmethylidene)amino)5(345trimethoxyphenyl)24dihydro3H124triazole3thione
4((1E)2(2THIENYL)1AZAVINYL)5(345TRIMETHOXYPHENYL)124TRIAZOLE3THIOL
4((E)THIOPHEN2YLMETHYLIDENEAMINO)3(345TRIMETHOXYPHENYL)1H124TRIAZOLE5THIONE
499118319
COC1=CC(=CC(=C1OC)OC)C2=NNC(=S)N2N=CC3=CC=CS3
COc1cc(cc(c1OC)OC)c1n(nH)c(=S)n1N=Cc1cccs1
InChI=1SC16H16N4O3S2c12112710(813(222)14(12)233)15181916(24)20(15)179115462511h49H13H3(H1924)b179+
MFCD07204778
ZINC000005558427
ZINC33303907
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