Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-{[5-(4-tert-butylphenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL294006
SMILES O=C(Nc1ccc2c(c1)OCO2)CSc1nnc(n1C)c1ccc(cc1)C(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 C22H24N4O3S MW 424.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O3S/c1-22(2,3)15-7-5-14(6-8-15)20-24-25-21(26(20)4)30-12-19(27)23-16-9-10-17-18(11-16)29-13-28-17/h5-11H,12-13H2,1-4H3,(H,23,27)InChIKey
XVPHUNMQGHRPJI-UHFFFAOYSA-NSynonyms
727712-17-6727712176
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C)SCC(=O)NC3=CC4=C(C=C3)OCO4
InChI=1SC22H24N4O3Sc122(23)157514(6815)20242521(26(20)4)301219(27)23169101718(1116)29132817h511H1213H214H3(H2327)
MFCD04618893
N(13BENZODIOXOL5YL)2((5(4TERTBUTYLPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(13benzodioxol5yl)2((5(4tertbutylphenyl)4methyl4H124triazol3yl)sulfanyl)acetamide
N(2H13BENZODIOXOL5YL)2((5(4TERTBUTYLPHENYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2HBENZO(34D)13DIOXOLEN5YL)2(5(4(TERTBUTYL)PHENYL)4METHYL(124TRIAZOL3YLTHIO))ACETAMIDE
N(benzo(d)(13)dioxol5yl)2((5(4(tertbutyl)phenyl)4methyl4H124triazol3yl)thio)acetamide
ZINC000002451212
ZINC02451212
ZINC2451212
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