Vitas-M small molecule compound
{3,5-bis[(4-ethoxybenzyl)amino]-1H-1,2,4-triazol-1-yl}(4-methylphenyl)methanone
Catalog ID
STK178976
SMILES CCOc1ccc(cc1)CNc1nc(n(n1)C(=O)c1ccc(cc1)C)NCc1ccc(cc1)OCC
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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 C28H31N5O3 MW 485.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N5O3/c1-4-35-24-14-8-21(9-15-24)18-29-27-31-28(30-19-22-10-16-25(17-11-22)36-5-2)33(32-27)26(34)23-12-6-20(3)7-13-23/h6-17H,4-5,18-19H2,1-3H3,(H2,29,30,31,32)InChIKey
VQJULCJOBOTUDI-UHFFFAOYSA-NSynonyms
(35BIS((4ETHOXYBENZYL)AMINO)1H124TRIAZOL1YL)(4METHYLPHENYL)METHANONE
(35bis((4ethoxyphenyl)methylamino)124triazol1yl)(4methylphenyl)methanone
CCOC1=CC=C(C=C1)CNC2=NN(C(=N2)NCC3=CC=C(C=C3)OCC)C(=O)C4=CC=C(C=C4)C
InChI=1SC28H31N5O3c14352414821(91524)1829273128(301922101625(171122)3652)33(3227)26(34)2312620(3)71323h617H451819H213H3(H229303132)
MFCD06664040
ZINC000009948638
ZINC09948638
ZINC9948638
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