Vitas-M small molecule compound

3-{[(2-phenyl-1,3-thiazol-4-yl)methyl]sulfanyl}-5-(propan-2-yl)-4-propyl-4H-1,2,4-triazole

Catalog ID
STK443179
SMILES CCCn1c(SCc2csc(n2)c2ccccc2)nnc1C(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 C18H22N4S2 MW 358.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4S2/c1-4-10-22-16(13(2)3)20-21-18(22)24-12-15-11-23-17(19-15)14-8-6-5-7-9-14/h5-9,11,13H,4,10,12H2,1-3H3
InChIKey
BTMCDQCDCXBLKA-UHFFFAOYSA-N
Synonyms

2phenyl4((5propan2yl4propyl124triazol3yl)sulfanylmethyl)13thiazole
3(((2phenyl13thiazol4yl)methyl)sulfanyl)5(propan2yl)4propyl4H124triazole
3(METHYLETHYL)5((2PHENYL(13THIAZOL4YL))METHYLTHIO)4PROPYL124TRIAZOLE
CCCN1C(=NN=C1SCC2=CSC(=N2)C3=CC=CC=C3)C(C)C
InChI=1SC18H22N4S2c14102216(13(2)3)202118(22)241215112317(1915)148657914h591113H41012H213H3
MFCD04054682
ZINC000006400376
ZINC06400376
ZINC6400376

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Available files

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