Vitas-M small molecule compound
4-{5-[(2-fluorobenzyl)sulfanyl]-4-methyl-4H-1,2,4-triazol-3-yl}aniline
Catalog ID
STK120258
SMILES Nc1ccc(cc1)c1nnc(n1C)SCc1ccccc1F
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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 C16H15FN4S MW 314.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15FN4S/c1-21-15(11-6-8-13(18)9-7-11)19-20-16(21)22-10-12-4-2-3-5-14(12)17/h2-9H,10,18H2,1H3InChIKey
OIOIRPHUPMSREC-UHFFFAOYSA-NSynonyms
4(5((2FLUOROBENZYL)SULFANYL)4METHYL4H124TRIAZOL3YL)ANILINE
4(5((2FLUOROPHENYL)METHYLSULFANYL)4METHYL124TRIAZOL3YL)ANILINE
CN1C(=NN=C1SCC2=CC=CC=C2F)C3=CC=C(C=C3)N
InChI=1SC16H15FN4Sc12115(116813(18)9711)192016(21)221012423514(12)17h29H1018H21H3
MFCD04328020
ZINC000004676138
ZINC04676138
ZINC4676138
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