Vitas-M small molecule compound

3-benzyl-4-methyl-5-[(3-methylbenzyl)sulfanyl]-4H-1,2,4-triazole

Catalog ID
STK415285
SMILES Cc1cccc(c1)CSc1nnc(n1C)Cc1ccccc1

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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 C18H19N3S MW 309.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3S/c1-14-7-6-10-16(11-14)13-22-18-20-19-17(21(18)2)12-15-8-4-3-5-9-15/h3-11H,12-13H2,1-2H3
InChIKey
SPGYHOAJOZRQMV-UHFFFAOYSA-N
Synonyms

3benzyl4methyl5((3methylbenzyl)sulfanyl)4H124triazole
3benzyl4methyl5((3methylphenyl)methylsulfanyl)124triazole
4METHYL5((3METHYLPHENYL)METHYLTHIO)3BENZYL124TRIAZOLE
CC1=CC(=CC=C1)CSC2=NN=C(N2C)CC3=CC=CC=C3
InChI=1SC18H19N3Sc114761016(1114)132218201917(21(18)2)12158435915h311H1213H212H3
MFCD06159002
ZINC000013325485
ZINC13325485

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.