Vitas-M small molecule compound
2-{[5-(4-methoxybenzyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(propan-2-yl)phenyl]acetamide
Catalog ID
STK116567
SMILES COc1ccc(cc1)Cc1nnc(n1C)SCC(=O)Nc1ccccc1C(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/c1-15(2)18-7-5-6-8-19(18)23-21(27)14-29-22-25-24-20(26(22)3)13-16-9-11-17(28-4)12-10-16/h5-12,15H,13-14H2,1-4H3,(H,23,27)InChIKey
GEGAKBHSYIVAAS-UHFFFAOYSA-NSynonyms
2((5((4METHOXYPHENYL)METHYL)4METHYL124TRIAZOL3YL)SULFANYL)N(2PROPAN2YLPHENYL)ACETAMIDE
2((5(4METHOXYBENZYL)4METHYL4H124TRIAZOL3YL)SULFANYL)N(2(PROPAN2YL)PHENYL)ACETAMIDE
CC(C)C1=CC=CC=C1NC(=O)CSC2=NN=C(N2C)CC3=CC=C(C=C3)OC
InChI=1SC22H26N4O2Sc115(2)18756819(18)2321(27)142922252420(26(22)3)131691117(284)121016h51215H1314H214H3(H2327)
MFCD03995947
ZINC000002836508
ZINC02836508
ZINC2836508
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