Vitas-M small molecule compound
ethyl 2-{[N-(4-ethoxyphenyl)-N-{[4-(methylsulfanyl)phenyl]sulfonyl}glycyl]amino}benzoate
Catalog ID
STL139516
SMILES CCOc1ccc(cc1)N(S(=O)(=O)c1ccc(cc1)SC)CC(=O)Nc1ccccc1C(=O)OCC
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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 C26H28N2O6S2 MW 528.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O6S2/c1-4-33-20-12-10-19(11-13-20)28(36(31,32)22-16-14-21(35-3)15-17-22)18-25(29)27-24-9-7-6-8-23(24)26(30)34-5-2/h6-17H,4-5,18H2,1-3H3,(H,27,29)InChIKey
BMCYAUULTKVNNV-UHFFFAOYSA-NSynonyms
CCOC1=CC=C(C=C1)N(CC(=O)NC2=CC=CC=C2C(=O)OCC)S(=O)(=O)C3=CC=C(C=C3)SC
ETHYL2((2(4ETHOXYN(4METHYLSULFANYLPHENYL)SULFONYLANILINO)ACETYL)AMINO)BENZOATE
ethyl2((N(4ethoxyphenyl)N((4(methylsulfanyl)phenyl)sulfonyl)glycyl)amino)benzoate
InChI=1SC26H28N2O6S2c143320121019(111320)28(36(3132)22161421(353)151722)1825(29)2724976823(24)26(30)3452h617H4518H213H3(H2729)
MFCD02219837
ZINC000059824132
ZINC59824132
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