Vitas-M small molecule compound

1-phenyl-5-[(2,4,6-trimethylbenzyl)sulfanyl]-1H-tetrazole

Catalog ID
STK147495
SMILES Cc1cc(C)c(c(c1)C)CSc1nnnn1c1ccccc1

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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 C17H18N4S MW 310.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4S/c1-12-9-13(2)16(14(3)10-12)11-22-17-18-19-20-21(17)15-7-5-4-6-8-15/h4-10H,11H2,1-3H3
InChIKey
DVZJKOXPVXFQOD-UHFFFAOYSA-N
Synonyms

1PHENYL5((246TRIMETHYLBENZYL)SULFANYL)1HTETRAZOLE
1PHENYL5((246TRIMETHYLPHENYL)METHYLSULFANYL)TETRAZOLE
CC1=CC(=C(C(=C1)C)CSC2=NN=NN2C3=CC=CC=C3)C
InChI=1SC17H18N4Sc112913(2)16(14(3)1012)11221718192021(17)157546815h410H11H213H3
MFCD04209786
ZINC000000469440
ZINC00469440
ZINC469440

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Available files

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