Vitas-M small molecule compound
4-methyl-3-{[3-(1H-tetrazol-1-yl)propanoyl]amino}benzoic acid
Catalog ID
STK696192
SMILES O=C(Nc1cc(ccc1C)C(=O)O)CCn1cnnn1
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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 C12H13N5O3 MW 275.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13N5O3/c1-8-2-3-9(12(19)20)6-10(8)14-11(18)4-5-17-7-13-15-16-17/h2-3,6-7H,4-5H2,1H3,(H,14,18)(H,19,20)InChIKey
FXYDUSVFTSUNMW-UHFFFAOYSA-NSynonyms
4methyl3((3(1Htetrazol1yl)propanoyl)amino)benzoicacid
4METHYL3(3(TETRAZOL1YL)PROPANOYLAMINO)BENZOICACID
CC1=C(C=C(C=C1)C(=O)O)NC(=O)CCN2C=NN=N2
InChI=1SC12H13N5O3c18239(12(19)20)610(8)1411(18)4517713151617h2367H45H21H3(H1418)(H1920)
MFCD02814371
ZINC000004743880
ZINC4743880
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