Vitas-M small molecule compound
1-(1,3-benzodioxol-5-ylmethyl)-1-[1-(4-ethoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-3-phenylthiourea
Catalog ID
STK066782
SMILES CCOc1ccc(cc1)N1C(=O)CC(C1=O)N(C(=S)Nc1ccccc1)Cc1ccc2c(c1)OCO2
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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 C27H25N3O5S MW 503.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O5S/c1-2-33-21-11-9-20(10-12-21)30-25(31)15-22(26(30)32)29(27(36)28-19-6-4-3-5-7-19)16-18-8-13-23-24(14-18)35-17-34-23/h3-14,22H,2,15-17H2,1H3,(H,28,36)InChIKey
HARSREYHOZXDPR-UHFFFAOYSA-NSynonyms
1023937-55-41(13BENZODIOXOL5YLMETHYL)1(1(4ETHOXYPHENYL)25DIOXOPYRROLIDIN3YL)3PHENYLTHIOUREA
1(benzo(d)(13)dioxol5ylmethyl)1(1(4ethoxyphenyl)25dioxopyrrolidin3yl)3phenylthiourea
1023937554
CCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)N(CC3=CC4=C(C=C3)OCO4)C(=S)NC5=CC=CC=C5
CCOc1ccc(cc1)N1C(=O)CC(C1=O)N(C(=S)Nc1ccccc1)Cc1ccc2c(c1)OCO2
InChI=1SC27H25N3O5Sc12332111920(101221)3025(31)1522(26(30)32)29(27(36)28196435719)16188132324(1418)35173423h31422H21517H21H3(H2836)
MFCD01625839
STK066782
ZINC000002287189
ZINC000100723417
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