Vitas-M small molecule compound
ethyl 4-(3-[3-(4-carbamoylpiperidin-1-yl)propyl]-4-{2-[(4-methoxyphenyl)amino]-2-oxoethyl}-5-oxo-2-thioxoimidazolidin-1-yl)benzoate
Catalog ID
STK662930
SMILES CCOC(=O)c1ccc(cc1)N1C(=S)N(C(C1=O)CC(=O)Nc1ccc(cc1)OC)CCCN1CCC(CC1)C(=O)N
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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 C30H37N5O6S MW 595.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H37N5O6S/c1-3-41-29(39)21-5-9-23(10-6-21)35-28(38)25(19-26(36)32-22-7-11-24(40-2)12-8-22)34(30(35)42)16-4-15-33-17-13-20(14-18-33)27(31)37/h5-12,20,25H,3-4,13-19H2,1-2H3,(H2,31,37)(H,32,36)InChIKey
WGTXENXPTQGMIO-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)N2C(=O)C(N(C2=S)CCCN3CCC(CC3)C(=O)N)CC(=O)NC4=CC=C(C=C4)OC
ETHYL4(3(3(4CARBAMOYLPIPERIDIN1YL)PROPYL)4(2((4METHOXYPHENYL)AMINO)2OXOETHYL)5OXO2THIOXOIMIDAZOLIDIN1YL)BENZOATE
ETHYL4(3(3(4CARBAMOYLPIPERIDIN1YL)PROPYL)4(2(4METHOXYANILINO)2OXOETHYL)5OXO2SULFANYLIDENEIMIDAZOLIDIN1YL)BENZOATE
InChI=1SC30H37N5O6Sc134129(39)215923(10621)3528(38)25(1926(36)322271124(402)12822)34(30(35)42)1641533171320(141833)27(31)37h5122025H341319H212H3(H23137)(H3236)
MFCD03916500
ZINC000098005913
ZINC000098005914
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