Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-({5-[(2,6-dimethylphenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Catalog ID
STK218608
SMILES C=CCn1c(SCC(=O)Nc2ccc3c(c2)OCO3)nnc1COc1c(C)cccc1C
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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 C23H24N4O4S MW 452.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4O4S/c1-4-10-27-20(12-29-22-15(2)6-5-7-16(22)3)25-26-23(27)32-13-21(28)24-17-8-9-18-19(11-17)31-14-30-18/h4-9,11H,1,10,12-14H2,2-3H3,(H,24,28)InChIKey
PCADBJMKMBAWLA-UHFFFAOYSA-NSynonyms
CC1=C(C(=CC=C1)C)OCC2=NN=C(N2CC=C)SCC(=O)NC3=CC4=C(C=C3)OCO4
InChI=1SC23H24N4O4Sc14102720(12292215(2)65716(22)3)252623(27)321321(28)2417891819(1117)31143018h4911H1101214H223H3(H2428)
MFCD07399459
N(13BENZODIOXOL5YL)2((5((26DIMETHYLPHENOXY)METHYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(13BENZODIOXOL5YL)2((5((26DIMETHYLPHENOXY)METHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000009263065
ZINC09263065
ZINC9263065
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