Vitas-M small molecule compound
N-(4-ethoxyphenyl)-3-{[4-(prop-2-en-1-yl)-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}propanamide
Catalog ID
STK283175
SMILES C=CCn1c(SCCC(=O)Nc2ccc(cc2)OCC)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 C21H23N5O2S MW 409.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O2S/c1-3-14-26-20(16-9-12-22-13-10-16)24-25-21(26)29-15-11-19(27)23-17-5-7-18(8-6-17)28-4-2/h3,5-10,12-13H,1,4,11,14-15H2,2H3,(H,23,27)InChIKey
FRFPPIRRCNQKGB-UHFFFAOYSA-NSynonyms
CCOC1=CC=C(C=C1)NC(=O)CCSC2=NN=C(N2CC=C)C3=CC=NC=C3
InChI=1SC21H23N5O2Sc13142620(1691222131016)242521(26)29151119(27)23175718(8617)2842h35101213H14111415H22H3(H2327)
MFCD09227919
N(4ethoxyphenyl)3((4(prop2en1yl)5(pyridin4yl)4H124triazol3yl)sulfanyl)propanamide
N(4ethoxyphenyl)3((4prop2enyl5pyridin4yl124triazol3yl)sulfanyl)propanamide
ZINC000010447804
ZINC10447804
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