Vitas-M small molecule compound
4-{[(E)-anthracen-9-ylmethylidene]amino}-5-(3,4,5-trimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK575031
SMILES COc1cc(cc(c1OC)OC)c1n[nH]c(=S)n1/N=C/c1c2ccccc2cc2c1cccc2
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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 C26H22N4O3S MW 470.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N4O3S/c1-31-22-13-18(14-23(32-2)24(22)33-3)25-28-29-26(34)30(25)27-15-21-19-10-6-4-8-16(19)12-17-9-5-7-11-20(17)21/h4-15H,1-3H3,(H,29,34)/b27-15+InChIKey
LBGDFQCYVXQPCU-JFLMPSFJSA-NSynonyms
496799-30-54(((E)anthracen9ylmethylidene)amino)5(345trimethoxyphenyl)24dihydro3H124triazole3thione
4((E)ANTHRACEN9YLMETHYLIDENEAMINO)3(345TRIMETHOXYPHENYL)1H124TRIAZOLE5THIONE
496799305
COC1=CC(=CC(=C1OC)OC)C2=NNC(=S)N2N=CC3=C4C=CC=CC4=CC5=CC=CC=C53
COc1cc(cc(c1OC)OC)c1n(nH)c(=S)n1N=Cc1c2ccccc2cc2c1cccc2
InChI=1SC26H22N4O3Sc131221318(1423(322)24(22)333)25282926(34)30(25)271521191064816(19)12179571120(17)21h415H13H3(H2934)b2715+
MFCD07201990
ZINC000009358278
ZINC33352676
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