Vitas-M small molecule compound
{3,5-bis[(2-methoxybenzyl)amino]-1H-1,2,4-triazol-1-yl}(3,4-dimethoxyphenyl)methanone
Catalog ID
STK178867
SMILES COc1ccccc1CNc1nc(nn1C(=O)c1ccc(c(c1)OC)OC)NCc1ccccc1OC
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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 C27H29N5O5 MW 503.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O5/c1-34-21-11-7-5-9-19(21)16-28-26-30-27(29-17-20-10-6-8-12-22(20)35-2)32(31-26)25(33)18-13-14-23(36-3)24(15-18)37-4/h5-15H,16-17H2,1-4H3,(H2,28,29,30,31)InChIKey
BWJZAGYYQRHIAB-UHFFFAOYSA-NSynonyms
(35BIS((2METHOXYBENZYL)AMINO)1H124TRIAZOL1YL)(34DIMETHOXYPHENYL)METHANONE
(35bis((2methoxyphenyl)methylamino)124triazol1yl)(34dimethoxyphenyl)methanone
COC1=C(C=C(C=C1)C(=O)N2C(=NC(=N2)NCC3=CC=CC=C3OC)NCC4=CC=CC=C4OC)OC
InChI=1SC27H29N5O5c134211175919(21)1628263027(29172010681222(20)352)32(3126)25(33)18131423(363)24(1518)374h515H1617H214H3(H228293031)
MFCD06663940
ZINC000009948505
ZINC09948505
ZINC9948505
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