Vitas-M small molecule compound
N-[3-(1,3-dioxan-2-yl)phenyl]-5-methyl-2-phenyl-2H-1,2,3-triazole-4-carboxamide
Catalog ID
STK665877
SMILES O=C(c1nn(nc1C)c1ccccc1)Nc1cccc(c1)C1OCCCO1
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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 C20H20N4O3 MW 364.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O3/c1-14-18(23-24(22-14)17-9-3-2-4-10-17)19(25)21-16-8-5-7-15(13-16)20-26-11-6-12-27-20/h2-5,7-10,13,20H,6,11-12H2,1H3,(H,21,25)InChIKey
PAQLHMFGIODPNZ-UHFFFAOYSA-NSynonyms
CC1=NN(N=C1C(=O)NC2=CC=CC(=C2)C3OCCCO3)C4=CC=CC=C4
InChI=1SC20H20N4O3c11418(2324(2214)1793241017)19(25)211685715(1316)2026116122720h257101320H61112H21H3(H2125)
MFCD12034056
N(3(13DIOXAN2YL)PHENYL)(5METHYL2PHENYL(123TRIAZOL4YL))CARBOXAMIDE
N(3(13dioxan2yl)phenyl)5methyl2phenyl2H123triazole4carboxamide
N(3(13dioxan2yl)phenyl)5methyl2phenyltriazole4carboxamide
ZINC000015108979
ZINC15108979
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