Vitas-M small molecule compound
4-{[({1-[3-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}sulfanyl)acetyl]amino}benzoic acid
Catalog ID
STK237196
SMILES O=C(Nc1ccc(cc1)C(=O)O)CSc1nnnn1c1cccc(c1)C(F)(F)F
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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 C17H12F3N5O3S MW 423.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12F3N5O3S/c18-17(19,20)11-2-1-3-13(8-11)25-16(22-23-24-25)29-9-14(26)21-12-6-4-10(5-7-12)15(27)28/h1-8H,9H2,(H,21,26)(H,27,28)InChIKey
FYLVOASFMBPYRI-UHFFFAOYSA-NSynonyms
901667-64-94((((1(3(trifluoromethyl)phenyl)1Htetrazol5yl)sulfanyl)acetyl)amino)benzoicacid
4((2(1(3(trifluoromethyl)phenyl)tetrazol5yl)sulfanylacetyl)amino)benzoicacid
4(2((1(3(trifluoromethyl)phenyl)1Htetrazol5yl)thio)acetamido)benzoicacid
901667649
C1=CC(=CC(=C1)N2C(=NN=N2)SCC(=O)NC3=CC=C(C=C3)C(=O)O)C(F)(F)F
InChI=1SC17H12F3N5O3Sc1817(1920)1121313(811)2516(22232425)29914(26)21126410(5712)15(27)28h18H9H2(H2126)(H2728)
MFCD06431333
ZINC000013729692
ZINC13729692
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