Vitas-M small molecule compound
1-{3,5-bis[(4-methylbenzyl)amino]-1H-1,2,4-triazol-1-yl}-3-methylbutan-1-one
Catalog ID
STK178953
SMILES Cc1ccc(cc1)CNc1nc(n(n1)C(=O)CC(C)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 C23H29N5O MW 391.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N5O/c1-16(2)13-21(29)28-23(25-15-20-11-7-18(4)8-12-20)26-22(27-28)24-14-19-9-5-17(3)6-10-19/h5-12,16H,13-15H2,1-4H3,(H2,24,25,26,27)InChIKey
LNMWNGQEIIVRMO-UHFFFAOYSA-NSynonyms
1(35BIS((4METHYLBENZYL)AMINO)1H124TRIAZOL1YL)3METHYLBUTAN1ONE
1(35BIS((4METHYLPHENYL)METHYLAMINO)124TRIAZOL1YL)3METHYLBUTAN1ONE
CC1=CC=C(C=C1)CNC2=NN(C(=N2)NCC3=CC=C(C=C3)C)C(=O)CC(C)C
InChI=1SC23H29N5Oc116(2)1321(29)2823(25152011718(4)81220)2622(2728)2414199517(3)61019h51216H1315H214H3(H224252627)
MFCD06664017
ZINC000004704925
ZINC04704925
ZINC4704925
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