Vitas-M small molecule compound
4-[5-({2-oxo-2-[(2-phenylethyl)amino]ethyl}sulfanyl)-1H-tetrazol-1-yl]benzoic acid
Catalog ID
STK514359
SMILES O=C(CSc1nnnn1c1ccc(cc1)C(=O)O)NCCc1ccccc1
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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 C18H17N5O3S MW 383.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N5O3S/c24-16(19-11-10-13-4-2-1-3-5-13)12-27-18-20-21-22-23(18)15-8-6-14(7-9-15)17(25)26/h1-9H,10-12H2,(H,19,24)(H,25,26)InChIKey
MNKLBHIPYHYRAT-UHFFFAOYSA-NSynonyms
1091582-21-61091582216
4(5((2OXO2((2PHENYLETHYL)AMINO)ETHYL)SULFANYL)1HTETRAAZOL1YL)BENZOICACID
4(5((2oxo2((2phenylethyl)amino)ethyl)sulfanyl)1Htetrazol1yl)benzoicacid
4(5((2oxo2(phenethylamino)ethyl)thio)1Htetrazol1yl)benzoicacid
4(5(2oxo2(2phenylethylamino)ethyl)sulfanyltetrazol1yl)benzoicacid
C1=CC=C(C=C1)CCNC(=O)CSC2=NN=NN2C3=CC=C(C=C3)C(=O)O
InChI=1SC18H17N5O3Sc2416(191110134213513)12271820212223(18)158614(7915)17(25)26h19H1012H2(H1924)(H2526)
MFCD13370734
ZINC000019854261
ZINC19854261
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