Vitas-M small molecule compound
ethyl N-({5-[4-(methylsulfanyl)phenyl]-2H-tetrazol-2-yl}acetyl)phenylalaninate
Catalog ID
STK772245
SMILES CCOC(=O)C(Cc1ccccc1)NC(=O)Cn1nnc(n1)c1ccc(cc1)SC
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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 C21H23N5O3S MW 425.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O3S/c1-3-29-21(28)18(13-15-7-5-4-6-8-15)22-19(27)14-26-24-20(23-25-26)16-9-11-17(30-2)12-10-16/h4-12,18H,3,13-14H2,1-2H3,(H,22,27)InChIKey
YDNQXIPKFRXTGC-UHFFFAOYSA-NSynonyms
CCOC(=O)C(CC1=CC=CC=C1)NC(=O)CN2N=C(N=N2)C3=CC=C(C=C3)SC
ETHYL2((2(5(4METHYLSULFANYLPHENYL)TETRAZOL2YL)ACETYL)AMINO)3PHENYLPROPANOATE
ethylN((5(4(methylsulfanyl)phenyl)2Htetrazol2yl)acetyl)phenylalaninate
InChI=1SC21H23N5O3Sc132921(28)18(13157546815)2219(27)14262420(232526)1691117(302)121016h41218H31314H212H3(H2227)
MFCD03768616
ZINC000003624966
ZINC000003624968
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