Vitas-M small molecule compound
ethyl 2-{[4-(2,4-dichlorophenoxy)butanoyl]amino}-5-{[2-(ethoxycarbonyl)phenyl]carbamoyl}-4-methylthiophene-3-carboxylate
Catalog ID
STK018378
SMILES CCOC(=O)c1c(NC(=O)CCCOc2ccc(cc2Cl)Cl)sc(c1C)C(=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 C28H28Cl2N2O7S MW 607.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28Cl2N2O7S/c1-4-37-27(35)18-9-6-7-10-20(18)31-25(34)24-16(3)23(28(36)38-5-2)26(40-24)32-22(33)11-8-14-39-21-13-12-17(29)15-19(21)30/h6-7,9-10,12-13,15H,4-5,8,11,14H2,1-3H3,(H,31,34)(H,32,33)InChIKey
YICRRLYYNCVRNR-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=CC=C1NC(=O)C2=C(C(=C(S2)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl)C(=O)OCC)C
CCOC(=O)c1c(NC(=O)CCCOc2ccc(cc2Cl)Cl)sc(c1C)C(=O)Nc1ccccc1C(=O)OCC
ETHYL2((4(24DICHLOROPHENOXY)BUTANOYL)AMINO)5((2(ETHOXYCARBONYL)PHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2((5(4(24DICHLOROPHENOXY)BUTANOYLAMINO)4(ETHOXYCARBONYL)3METHYL2THIENYL)CARBONYLAMINO)BENZOATE
ETHYL2(4(24DICHLOROPHENOXY)BUTANOYLAMINO)5((2ETHOXYCARBONYLPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC28H28Cl2N2O7Sc143727(35)189671020(18)3125(34)2416(3)23(28(36)3852)26(4024)3222(33)118143921131217(29)1519(21)30h67910121315H4581114H213H3(H3134)(H3233)
MFCD02104437
STK018378
ZINC000100097441
ZINC100097441
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