Vitas-M small molecule compound
N-(2-tert-butylphenyl)-2-{[4-(prop-2-en-1-yl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL342216
SMILES C=CCn1c(SCC(=O)Nc2ccccc2C(C)(C)C)nnc1c1cccnc1
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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 C22H25N5OS MW 407.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5OS/c1-5-13-27-20(16-9-8-12-23-14-16)25-26-21(27)29-15-19(28)24-18-11-7-6-10-17(18)22(2,3)4/h5-12,14H,1,13,15H2,2-4H3,(H,24,28)InChIKey
YXAVJKQFWYHWQK-UHFFFAOYSA-NSynonyms
586998-08-52((4allyl5(pyridin3yl)4H124triazol3yl)thio)N(2(tertbutyl)phenyl)acetamide
586998085
CC(C)(C)C1=CC=CC=C1NC(=O)CSC2=NN=C(N2CC=C)C3=CN=CC=C3
InChI=1SC22H25N5OSc15132720(169812231416)252621(27)291519(28)241811761017(18)22(23)4h51214H11315H224H3(H2428)
MFCD04033543
N(2(TERTBUTYL)PHENYL)2(4PROP2ENYL5(3PYRIDYL)(124TRIAZOL3YLTHIO))ACETAMIDE
N(2tertbutylphenyl)2((4(prop2en1yl)5(pyridin3yl)4H124triazol3yl)sulfanyl)acetamide
N(2TERTBUTYLPHENYL)2((4PROP2ENYL5PYRIDIN3YL124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000002397548
ZINC02397548
ZINC2397548
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