Vitas-M small molecule compound
methyl 3-[({[5-({[(4-methoxyphenyl)carbonyl]amino}methyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK125481
SMILES COc1ccc(cc1)C(=O)NCc1nnc(n1C)SCC(=O)Nc1cccc(c1)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 C22H23N5O5S MW 469.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O5S/c1-27-18(12-23-20(29)14-7-9-17(31-2)10-8-14)25-26-22(27)33-13-19(28)24-16-6-4-5-15(11-16)21(30)32-3/h4-11H,12-13H2,1-3H3,(H,23,29)(H,24,28)InChIKey
NBFSLLUMXZJAJC-UHFFFAOYSA-NSynonyms
3(2(5((4METHOXYBENZOYLAMINO)METHYL)4METHYL4H(124)TRIAZOL3YLSULFANYL)ACETYLAMINO)BENZOICACIDMETHYLESTER
CN1C(=NN=C1SCC(=O)NC2=CC=CC(=C2)C(=O)OC)CNC(=O)C3=CC=C(C=C3)OC
InChI=1SC22H23N5O5Sc12718(122320(29)147917(312)10814)252622(27)331319(28)241664515(1116)21(30)323h411H1213H213H3(H2329)(H2428)
METHYL3((((5((((4METHOXYPHENYL)CARBONYL)AMINO)METHYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL3((((5(((4METHOXYBENZOYL)AMINO)METHYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL3((2((5(((4METHOXYBENZOYL)AMINO)METHYL)4METHYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
MFCD04154059
ZINC000000633786
ZINC00633786
ZINC633786
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Check stock on Vitas-MAvailable files
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