Vitas-M small molecule compound
ethyl 4-{[3-(4-methoxyphenyl)-4-phenyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl]methyl}piperazine-1-carboxylate
Catalog ID
STK733023
SMILES CCOC(=O)N1CCN(CC1)Cn1nc(n(c1=S)c1ccccc1)c1ccc(cc1)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 C23H27N5O3S MW 453.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N5O3S/c1-3-31-23(29)26-15-13-25(14-16-26)17-27-22(32)28(19-7-5-4-6-8-19)21(24-27)18-9-11-20(30-2)12-10-18/h4-12H,3,13-17H2,1-2H3InChIKey
RFFJMDISSOKWIK-UHFFFAOYSA-NSynonyms
311791-74-9311791749
CCOC(=O)N1CCN(CC1)CN2C(=S)N(C(=N2)C3=CC=C(C=C3)OC)C4=CC=CC=C4
ETHYL4((3(4METHOXYPHENYL)4PHENYL5SULFANYLIDENE124TRIAZOL1YL)METHYL)PIPERAZINE1CARBOXYLATE
ETHYL4((3(4METHOXYPHENYL)4PHENYL5THIOXO45DIHYDRO1H124TRIAZOL1YL)METHYL)1PIPERAZINECARBOXYLATE
ethyl4((3(4methoxyphenyl)4phenyl5thioxo45dihydro1H124triazol1yl)methyl)piperazine1carboxylate
InChI=1SC23H27N5O3Sc133123(29)26151325(141626)172722(32)28(197546819)21(2427)1891120(302)121018h412H31317H212H3
MFCD01207073
ZINC000019818238
ZINC19818238
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