Vitas-M small molecule compound
4-fluoro-N-{[5-({2-[(2-methoxy-5-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methyl}benzamide
Catalog ID
STL122247
SMILES C=CCn1c(CNC(=O)c2ccc(cc2)F)nnc1SCC(=O)Nc1cc(C)ccc1OC
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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 C23H24FN5O3S MW 469.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24FN5O3S/c1-4-11-29-20(13-25-22(31)16-6-8-17(24)9-7-16)27-28-23(29)33-14-21(30)26-18-12-15(2)5-10-19(18)32-3/h4-10,12H,1,11,13-14H2,2-3H3,(H,25,31)(H,26,30)InChIKey
KHDRDGNNVAVYBX-UHFFFAOYSA-NSynonyms
4fluoroN((5((2((2methoxy5methylphenyl)amino)2oxoethyl)sulfanyl)4(prop2en1yl)4H124triazol3yl)methyl)benzamide
4FLUORON((5(2(2METHOXY5METHYLANILINO)2OXOETHYL)SULFANYL4PROP2ENYL124TRIAZOL3YL)METHYL)BENZAMIDE
CC1=CC(=C(C=C1)OC)NC(=O)CSC2=NN=C(N2CC=C)CNC(=O)C3=CC=C(C=C3)F
InChI=1SC23H24FN5O3Sc14112920(132522(31)166817(24)9716)272823(29)331421(30)26181215(2)51019(18)323h41012H1111314H223H3(H2531)(H2630)
MFCD04387133
ZINC000016361413
ZINC16361413
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