Vitas-M small molecule compound
5-[3-(propan-2-yloxy)phenyl]-4-{[(E)-(2,4,5-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK578668
SMILES COc1cc(OC)c(cc1/C=N/n1c(=S)[nH]nc1c1cccc(c1)OC(C)C)OC
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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 C21H24N4O4S MW 428.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O4S/c1-13(2)29-16-8-6-7-14(9-16)20-23-24-21(30)25(20)22-12-15-10-18(27-4)19(28-5)11-17(15)26-3/h6-13H,1-5H3,(H,24,30)/b22-12+InChIKey
FVBGIJDGJHQCBM-WSDLNYQXSA-NSynonyms
578719-27-43(3PROPAN2YLOXYPHENYL)4((E)(245TRIMETHOXYPHENYL)METHYLIDENEAMINO)1H124TRIAZOLE5THIONE
4((1E)2(245TRIMETHOXYPHENYL)1AZAVINYL)5(3(METHYLETHOXY)PHENYL)124TRIAZOLE3THIOL
5(3(propan2yloxy)phenyl)4(((E)(245trimethoxyphenyl)methylidene)amino)24dihydro3H124triazole3thione
578719274
CC(C)OC1=CC=CC(=C1)C2=NNC(=S)N2N=CC3=CC(=C(C=C3OC)OC)OC
COc1cc(OC)c(cc1C=Nn1c(=S)(nH)nc1c1cccc(c1)OC(C)C)OC
InChI=1SC21H24N4O4Sc113(2)291686714(916)20232421(30)25(20)2212151018(274)19(285)1117(15)263h613H15H3(H2430)b2212+
MFCD07205299
ZINC000016995018
ZINC33364491
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