Vitas-M small molecule compound
(3,5-bis{[4-(propan-2-yl)benzyl]amino}-1H-1,2,4-triazol-1-yl)(furan-2-yl)methanone
Catalog ID
STK169930
SMILES CC(c1ccc(cc1)CNc1nn(c(n1)NCc1ccc(cc1)C(C)C)C(=O)c1ccco1)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 C27H31N5O2 MW 457.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N5O2/c1-18(2)22-11-7-20(8-12-22)16-28-26-30-27(32(31-26)25(33)24-6-5-15-34-24)29-17-21-9-13-23(14-10-21)19(3)4/h5-15,18-19H,16-17H2,1-4H3,(H2,28,29,30,31)InChIKey
MZPUBRXOJRNRIW-UHFFFAOYSA-NSynonyms
(35BIS((4(PROPAN2YL)BENZYL)AMINO)1H124TRIAZOL1YL)(FURAN2YL)METHANONE
(35bis((4propan2ylphenyl)methylamino)124triazol1yl)(furan2yl)methanone
CC(C)C1=CC=C(C=C1)CNC2=NN(C(=N2)NCC3=CC=C(C=C3)C(C)C)C(=O)C4=CC=CO4
InChI=1SC27H31N5O2c118(2)2211720(81222)1628263027(32(3126)25(33)2465153424)29172191323(141021)19(3)4h5151819H1617H214H3(H228293031)
MFCD06663443
ZINC000009847141
ZINC09847141
ZINC9847141
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