Vitas-M small molecule compound
(2E)-1-{3,5-bis[(2-chlorobenzyl)amino]-1H-1,2,4-triazol-1-yl}-3-(2-methoxyphenyl)prop-2-en-1-one
Catalog ID
STK178922
SMILES COc1ccccc1/C=C/C(=O)n1nc(nc1NCc1ccccc1Cl)NCc1ccccc1Cl
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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 C26H23Cl2N5O2 MW 508.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23Cl2N5O2/c1-35-23-13-7-4-8-18(23)14-15-24(34)33-26(30-17-20-10-3-6-12-22(20)28)31-25(32-33)29-16-19-9-2-5-11-21(19)27/h2-15H,16-17H2,1H3,(H2,29,30,31,32)/b15-14+InChIKey
UOVQDPKSXJDGAE-CCEZHUSRSA-NSynonyms
(2E)1(35BIS((2CHLOROBENZYL)AMINO)1H124TRIAZOL1YL)3(2METHOXYPHENYL)PROP2EN1ONE
(E)1(35bis((2chlorophenyl)methylamino)124triazol1yl)3(2methoxyphenyl)prop2en1one
COC1=CC=CC=C1C=CC(=O)N2C(=NC(=N2)NCC3=CC=CC=C3Cl)NCC4=CC=CC=C4Cl
COc1ccccc1C=CC(=O)n1nc(nc1NCc1ccccc1Cl)NCc1ccccc1Cl
InChI=1SC26H23Cl2N5O2c135231374818(23)141524(34)3326(30172010361222(20)28)3125(3233)2916199251121(19)27h215H1617H21H3(H229303132)b1514+
MFCD06663991
ZINC000009948595
ZINC09948595
ZINC9948595
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