Vitas-M small molecule compound
N-(2-ethyl-6-methylphenyl)-2-{[4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK261285
SMILES C=CCn1c(SCC(=O)Nc2c(C)cccc2CC)nnc1c1ccncc1
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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 C21H23N5OS MW 393.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5OS/c1-4-13-26-20(17-9-11-22-12-10-17)24-25-21(26)28-14-18(27)23-19-15(3)7-6-8-16(19)5-2/h4,6-12H,1,5,13-14H2,2-3H3,(H,23,27)InChIKey
GONQTXBIBDVDPK-UHFFFAOYSA-NSynonyms
562849-01-82((4allyl5(pyridin4yl)4H124triazol3yl)thio)N(2ethyl6methylphenyl)acetamide
562849018
CCC1=CC=CC(=C1NC(=O)CSC2=NN=C(N2CC=C)C3=CC=NC=C3)C
InChI=1SC21H23N5OSc14132620(1791122121017)242521(26)281418(27)231915(3)76816(19)52h4612H151314H223H3(H2327)
MFCD03822235
N(2ethyl6methylphenyl)2((4(prop2en1yl)5(pyridin4yl)4H124triazol3yl)sulfanyl)acetamide
N(2ETHYL6METHYLPHENYL)2((4PROP2ENYL5PYRIDIN4YL124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(6ETHYL2METHYLPHENYL)2(4PROP2ENYL5(4PYRIDYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000000778525
ZINC00778525
ZINC778525
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