Vitas-M small molecule compound
1-(1,3-benzodioxol-5-ylmethyl)-1-{1-[4-(hexyloxy)phenyl]-2,5-dioxopyrrolidin-3-yl}-3-phenylthiourea
Catalog ID
STK730977
SMILES CCCCCCOc1ccc(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 C31H33N3O5S MW 559.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33N3O5S/c1-2-3-4-8-17-37-25-14-12-24(13-15-25)34-29(35)19-26(30(34)36)33(31(40)32-23-9-6-5-7-10-23)20-22-11-16-27-28(18-22)39-21-38-27/h5-7,9-16,18,26H,2-4,8,17,19-21H2,1H3,(H,32,40)InChIKey
IBZNMOMDDMJADV-UHFFFAOYSA-NSynonyms
1(13benzodioxol5ylmethyl)1(1(4(hexyloxy)phenyl)25dioxopyrrolidin3yl)3phenylthiourea
1(13BENZODIOXOL5YLMETHYL)1(1(4HEXOXYPHENYL)25DIOXOPYRROLIDIN3YL)3PHENYLTHIOUREA
1(benzo(d)(13)dioxol5ylmethyl)1(1(4(hexyloxy)phenyl)25dioxopyrrolidin3yl)3phenylthiourea
CCCCCCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)N(CC3=CC4=C(C=C3)OCO4)C(=S)NC5=CC=CC=C5
InChI=1SC31H33N3O5Sc12348173725141224(131525)3429(35)1926(30(34)36)33(31(40)322396571023)202211162728(1822)39213827h579161826H248171921H21H3(H3240)
MFCD01541808
ZINC000102643602
ZINC000102643606
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