Vitas-M small molecule compound
1-{3,5-bis[(4-ethoxybenzyl)amino]-1H-1,2,4-triazol-1-yl}-2-phenylethanone
Catalog ID
STK178968
SMILES CCOc1ccc(cc1)CNc1nc(n(n1)C(=O)Cc1ccccc1)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/c1-3-35-24-14-10-22(11-15-24)19-29-27-31-28(30-20-23-12-16-25(17-13-23)36-4-2)33(32-27)26(34)18-21-8-6-5-7-9-21/h5-17H,3-4,18-20H2,1-2H3,(H2,29,30,31,32)InChIKey
SYINILPYPUUECO-UHFFFAOYSA-NSynonyms
1(35BIS((4ETHOXYBENZYL)AMINO)1H124TRIAZOL1YL)2PHENYLETHANONE
1(35bis((4ethoxyphenyl)methylamino)124triazol1yl)2phenylethanone
CCOC1=CC=C(C=C1)CNC2=NN(C(=N2)NCC3=CC=C(C=C3)OCC)C(=O)CC4=CC=CC=C4
InChI=1SC28H31N5O3c133524141022(111524)1929273128(302023121625(171323)3642)33(3227)26(34)18218657921h517H341820H212H3(H229303132)
MFCD06664032
ZINC000009948630
ZINC09948630
ZINC9948630
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