Vitas-M small molecule compound
{3,5-bis[(4-methylbenzyl)amino]-1H-1,2,4-triazol-1-yl}(3,4,5-trimethoxyphenyl)methanone
Catalog ID
STK178954
SMILES COc1c(OC)cc(cc1OC)C(=O)n1nc(nc1NCc1ccc(cc1)C)NCc1ccc(cc1)C
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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 C28H31N5O4 MW 501.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N5O4/c1-18-6-10-20(11-7-18)16-29-27-31-28(30-17-21-12-8-19(2)9-13-21)33(32-27)26(34)22-14-23(35-3)25(37-5)24(15-22)36-4/h6-15H,16-17H2,1-5H3,(H2,29,30,31,32)InChIKey
GQGWHNCRVUIZBS-UHFFFAOYSA-NSynonyms
(35BIS((4METHYLBENZYL)AMINO)1H124TRIAZOL1YL)(345TRIMETHOXYPHENYL)METHANONE
(35bis((4methylphenyl)methylamino)124triazol1yl)(345trimethoxyphenyl)methanone
CC1=CC=C(C=C1)CNC2=NN(C(=N2)NCC3=CC=C(C=C3)C)C(=O)C4=CC(=C(C(=C4)OC)OC)OC
InChI=1SC28H31N5O4c11861020(11718)1629273128(30172112819(2)91321)33(3227)26(34)221423(353)25(375)24(1522)364h615H1617H215H3(H229303132)
MFCD06664018
ZINC000009948620
ZINC09948620
ZINC9948620
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