Vitas-M small molecule compound
4-chloro-N-{[5-({2-[(4-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-4-methyl-4H-1,2,4-triazol-3-yl]methyl}benzamide
Catalog ID
STK115040
SMILES O=C(Nc1ccc(cc1)F)CSc1nnc(n1C)CNC(=O)c1ccc(cc1)Cl
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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 C19H17ClFN5O2S MW 433.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17ClFN5O2S/c1-26-16(10-22-18(28)12-2-4-13(20)5-3-12)24-25-19(26)29-11-17(27)23-15-8-6-14(21)7-9-15/h2-9H,10-11H2,1H3,(H,22,28)(H,23,27)InChIKey
DHNONGBESVWBRK-UHFFFAOYSA-NSynonyms
4CHLORON((5((2((4FLUOROPHENYL)AMINO)2OXOETHYL)SULFANYL)4METHYL4H124TRIAZOL3YL)METHYL)BENZAMIDE
4CHLORON((5(2(4FLUOROANILINO)2OXOETHYL)SULFANYL4METHYL124TRIAZOL3YL)METHYL)BENZAMIDE
CN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)F)CNC(=O)C3=CC=C(C=C3)Cl
InChI=1SC19H17ClFN5O2Sc12616(102218(28)122413(20)5312)242519(26)291117(27)23158614(21)7915h29H1011H21H3(H2228)(H2327)
MFCD04127925
ZINC000001119599
ZINC01119599
ZINC1119599
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