Vitas-M small molecule compound
N-benzyl-2-[(4-methyl-5-{[4-(propan-2-yl)phenoxy]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Catalog ID
STK139727
SMILES O=C(NCc1ccccc1)CSc1nnc(n1C)COc1ccc(cc1)C(C)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 C22H26N4O2S MW 410.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O2S/c1-16(2)18-9-11-19(12-10-18)28-14-20-24-25-22(26(20)3)29-15-21(27)23-13-17-7-5-4-6-8-17/h4-12,16H,13-15H2,1-3H3,(H,23,27)InChIKey
NUISOJUSRGHOGJ-UHFFFAOYSA-NSynonyms
CC(C)C1=CC=C(C=C1)OCC2=NN=C(N2C)SCC(=O)NCC3=CC=CC=C3
InChI=1SC22H26N4O2Sc116(2)1891119(121018)281420242522(26(20)3)291521(27)2313177546817h41216H1315H213H3(H2327)
MFCD04090728
NBENZYL2((4METHYL5((4(PROPAN2YL)PHENOXY)METHYL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
NBENZYL2((4METHYL5((4PROPAN2YLPHENOXY)METHYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
NBENZYL2((5((4ISOPROPYLPHENOXY)METHYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000000686620
ZINC00686620
ZINC686620
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