Vitas-M small molecule compound
3-[(4-fluorobenzyl)sulfanyl]-4-methyl-5-(propan-2-yl)-4H-1,2,4-triazole
Catalog ID
STK475880
SMILES Fc1ccc(cc1)CSc1nnc(n1C)C(C)C
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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 C13H16FN3S MW 265.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16FN3S/c1-9(2)12-15-16-13(17(12)3)18-8-10-4-6-11(14)7-5-10/h4-7,9H,8H2,1-3H3InChIKey
DKBRSWTYFWSMKD-UHFFFAOYSA-NSynonyms
3((4fluorobenzyl)sulfanyl)4methyl5(propan2yl)4H124triazole
3((4FLUOROPHENYL)METHYLSULFANYL)4METHYL5PROPAN2YL124TRIAZOLE
5((4FLUOROPHENYL)METHYLTHIO)4METHYL3(METHYLETHYL)124TRIAZOLE
CC(C)C1=NN=C(N1C)SCC2=CC=C(C=C2)F
InChI=1SC13H16FN3Sc19(2)12151613(17(12)3)188104611(14)7510h479H8H213H3
MFCD07035412
ZINC000006726606
ZINC06726606
ZINC6726606
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