Vitas-M small molecule compound
methyl N-{[(3-amino-1H-1,2,4-triazol-5-yl)sulfanyl]acetyl}phenylalaninate
Catalog ID
STK136937
SMILES COC(=O)C(Cc1ccccc1)NC(=O)CSc1[nH]nc(n1)N
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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 C14H17N5O3S MW 335.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H17N5O3S/c1-22-12(21)10(7-9-5-3-2-4-6-9)16-11(20)8-23-14-17-13(15)18-19-14/h2-6,10H,7-8H2,1H3,(H,16,20)(H3,15,17,18,19)InChIKey
IUTUIVVBPNTGRK-UHFFFAOYSA-NSynonyms
1009527-42-71009527427
COC(=O)C(CC1=CC=CC=C1)NC(=O)CSC2=NNC(=N2)N
COC(=O)C(Cc1ccccc1)NC(=O)CSc1(nH)nc(n1)N
InChI=1SC14H17N5O3Sc12212(21)10(79532469)1611(20)823141713(15)181914h2610H78H21H3(H1620)(H315171819)
METHYL2((2((5AMINO1H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)3PHENYLPROPANOATE
METHYLN(((3AMINO1H124TRIAZOL5YL)SULFANYL)ACETYL)PHENYLALANINATE
METHYLN(((5AMINO1H124TRIAZOL3YL)SULFANYL)ACETYL)PHENYLALANINATE
MFCD02817361
ZINC000007897349
ZINC000007897350
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