Vitas-M small molecule compound

1-(4-methylphenyl)-2-(5-phenyl-2H-tetrazol-2-yl)ethanone

Catalog ID
STK926240
SMILES Cc1ccc(cc1)C(=O)Cn1nnc(n1)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 C16H14N4O MW 278.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N4O/c1-12-7-9-13(10-8-12)15(21)11-20-18-16(17-19-20)14-5-3-2-4-6-14/h2-10H,11H2,1H3
InChIKey
QLXSTCVSPXYBAT-UHFFFAOYSA-N
Synonyms

1(4methylphenyl)2(5phenyl2Htetrazol2yl)ethanone
1(4METHYLPHENYL)2(5PHENYLTETRAZOL2YL)ETHANONE
2(5phenyl2Htetrazol2yl)1(ptolyl)ethanone
2(5PHENYLTETRAZOL2YL)1PTOLYLETHANONE
CC1=CC=C(C=C1)C(=O)CN2N=C(N=N2)C3=CC=CC=C3
InChI=1SC16H14N4Oc1127913(10812)15(21)11201816(171920)145324614h210H11H21H3
MFCD01419606
ZINC000000045499
ZINC00045499
ZINC45499

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Available files

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