Vitas-M small molecule compound
3-({[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]acetyl}amino)-3-(4-methoxyphenyl)propanoic acid
Catalog ID
STK682932
SMILES COc1ccc(cc1)C(CC(=O)O)NC(=O)CSc1nnc(s1)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 C14H16N4O4S2 MW 368.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16N4O4S2/c1-22-9-4-2-8(3-5-9)10(6-12(20)21)16-11(19)7-23-14-18-17-13(15)24-14/h2-5,10H,6-7H2,1H3,(H2,15,17)(H,16,19)(H,20,21)InChIKey
LTOPDXMGQAYQEL-UHFFFAOYSA-NSynonyms
3((((5amino134thiadiazol2yl)sulfanyl)acetyl)amino)3(4methoxyphenyl)propanoicacid
3((2((5AMINO134THIADIAZOL2YL)SULFANYL)ACETYL)AMINO)3(4METHOXYPHENYL)PROPANOICACID
COC1=CC=C(C=C1)C(CC(=O)O)NC(=O)CSC2=NN=C(S2)N
InChI=1SC14H16N4O4S2c1229428(359)10(612(20)21)1611(19)72314181713(15)2414h2510H67H21H3(H21517)(H1619)(H2021)
MFCD04061373
ZINC000004653856
ZINC000004653857
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