Vitas-M small molecule compound

1-(2,4-dimethylphenyl)-5-[(phenylsulfonyl)methyl]-1H-tetrazole

Catalog ID
STK853666
SMILES Cc1ccc(c(c1)C)n1nnnc1CS(=O)(=O)c1ccccc1

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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 C16H16N4O2S MW 328.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O2S/c1-12-8-9-15(13(2)10-12)20-16(17-18-19-20)11-23(21,22)14-6-4-3-5-7-14/h3-10H,11H2,1-2H3
InChIKey
KRQMRUOYWSHRTJ-UHFFFAOYSA-N
Synonyms
898653-25-3
1(24dimethylphenyl)5((phenylsulfonyl)methyl)1Htetrazole
5(BENZENESULFONYLMETHYL)1(24DIMETHYLPHENYL)TETRAZOLE
898653253
CC1=CC(=C(C=C1)N2C(=NN=N2)CS(=O)(=O)C3=CC=CC=C3)C
InChI=1SC16H16N4O2Sc1128915(13(2)1012)2016(17181920)1123(2122)146435714h310H11H212H3
MFCD08291893
ZINC000006760348
ZINC06760348
ZINC6760348

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Available files

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