Vitas-M small molecule compound
ethyl 4-{[({4-amino-5-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzoate
Catalog ID
STK579040
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1N)c1n[nH]c(c1)c1ccc(cc1)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 C23H23N7O4S MW 493.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N7O4S/c1-3-34-22(32)15-4-8-16(9-5-15)25-20(31)13-35-23-29-28-21(30(23)24)19-12-18(26-27-19)14-6-10-17(33-2)11-7-14/h4-12H,3,13,24H2,1-2H3,(H,25,31)(H,26,27)InChIKey
MSQYZRORAKJKQS-UHFFFAOYSA-NSynonyms
879451-39-5879451395
CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2N)C3=CC(=NN3)C4=CC=C(C=C4)OC
CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1N)c1(nH)nc(c1)c1ccc(cc1)OC
CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1N)c1n(nH)c(c1)c1ccc(cc1)OC
ethyl4((((4amino5(5(4methoxyphenyl)1Hpyrazol3yl)4H124triazol3yl)sulfanyl)acetyl)amino)benzoate
ETHYL4((2((4AMINO5(3(4METHOXYPHENYL)1HPYRAZOL5YL)124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
ethyl4(2((4amino5(3(4methoxyphenyl)1Hpyrazol5yl)4H124triazol3yl)thio)acetamido)benzoate
ETHYL4(2(4AMINO5(3(4METHOXYPHENYL)PYRAZOL5YL)124TRIAZOL3YLTHIO)ACETYLAMINO)BENZOATE
InChI=1SC23H23N7O4Sc133422(32)154816(9515)2520(31)133523292821(30(23)24)191218(262719)1461017(332)11714h412H31324H212H3(H2531)(H2627)
MFCD07200612
ZINC000009540836
ZINC09540836
ZINC9540836
Check stock
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Check stock on Vitas-MAvailable files
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