Vitas-M small molecule compound
methyl 4-[({[4-amino-5-(3-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL228765
SMILES COc1cccc(c1)c1nnc(n1N)SCC(=O)Nc1ccc(cc1)C(=O)OC
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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 C19H19N5O4S MW 413.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N5O4S/c1-27-15-5-3-4-13(10-15)17-22-23-19(24(17)20)29-11-16(25)21-14-8-6-12(7-9-14)18(26)28-2/h3-10H,11,20H2,1-2H3,(H,21,25)InChIKey
ASQOIYCEKZZONP-UHFFFAOYSA-NSynonyms
578761-16-7578761167
COC1=CC=CC(=C1)C2=NN=C(N2N)SCC(=O)NC3=CC=C(C=C3)C(=O)OC
InChI=1SC19H19N5O4Sc1271553413(1015)17222319(24(17)20)291116(25)21148612(7914)18(26)282h310H1120H212H3(H2125)
methyl4((((4amino5(3methoxyphenyl)4H124triazol3yl)sulfanyl)acetyl)amino)benzoate
METHYL4((2((4AMINO5(3METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
methyl4(2((4amino5(3methoxyphenyl)4H124triazol3yl)thio)acetamido)benzoate
MFCD04025411
ZINC000002372209
ZINC02372209
ZINC2372209
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