Vitas-M small molecule compound

3-[(4-bromobenzyl)sulfanyl]-4-(2-methylpropyl)-5-phenyl-4H-1,2,4-triazole

Catalog ID
STL379496
SMILES CC(Cn1c(SCc2ccc(cc2)Br)nnc1c1ccccc1)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 C19H20BrN3S MW 402.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20BrN3S/c1-14(2)12-23-18(16-6-4-3-5-7-16)21-22-19(23)24-13-15-8-10-17(20)11-9-15/h3-11,14H,12-13H2,1-2H3
InChIKey
JOQVXZPPHNVJBL-UHFFFAOYSA-N
Synonyms

3((4bromobenzyl)sulfanyl)4(2methylpropyl)5phenyl4H124triazole
3((4BROMOPHENYL)METHYLSULFANYL)4(2METHYLPROPYL)5PHENYL124TRIAZOLE
4BROMOBENZYL4ISOBUTYL5PHENYL4H124TRIAZOL3YLSULFIDE
CC(C)CN1C(=NN=C1SCC2=CC=C(C=C2)Br)C3=CC=CC=C3
InChI=1SC19H20BrN3Sc114(2)122318(166435716)212219(23)24131581017(20)11915h31114H1213H212H3
MFCD03862113
ZINC000002128651
ZINC02128651
ZINC2128651

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Available files

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