Vitas-M small molecule compound
2-({4-methyl-5-[1-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)ethyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-[4-(morpholin-4-yl)phenyl]acetamide
Catalog ID
STL365495
SMILES O=C(Nc1ccc(cc1)N1CCOCC1)CSc1nnc(n1C)C(N1C(=O)COc2c1cccc2)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 C25H28N6O4S MW 508.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N6O4S/c1-17(31-20-5-3-4-6-21(20)35-15-23(31)33)24-27-28-25(29(24)2)36-16-22(32)26-18-7-9-19(10-8-18)30-11-13-34-14-12-30/h3-10,17H,11-16H2,1-2H3,(H,26,32)InChIKey
XASGIAWFWZKQHF-UHFFFAOYSA-NSynonyms
2((4methyl5(1(3oxo14benzoxazin4yl)ethyl)124triazol3yl)sulfanyl)N(4morpholin4ylphenyl)acetamide
2((4methyl5(1(3oxo23dihydro4H14benzoxazin4yl)ethyl)4H124triazol3yl)sulfanyl)N(4(morpholin4yl)phenyl)acetamide
CC(C1=NN=C(N1C)SCC(=O)NC2=CC=C(C=C2)N3CCOCC3)N4C(=O)COC5=CC=CC=C54
InChI=1SC25H28N6O4Sc117(3120534621(20)351523(31)33)24272825(29(24)2)361622(32)26187919(10818)30111334141230h31017H1116H212H3(H2632)
MFCD09476308
ZINC000015019062
ZINC000015019063
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