Vitas-M small molecule compound

1-(1,3-dimethyl-2,4,6-trioxo-1,1',2',3,3',3a',4,6-octahydro-2H,5'H-spiro[pyrimidine-5,4'-pyrrolo[1,2-a]quinolin]-7'-yl)-3-phenylthiourea

Catalog ID
STK590656
SMILES S=C(Nc1ccccc1)Nc1ccc2c(c1)CC1(C3N2CCC3)C(=O)N(C)C(=O)N(C1=O)C

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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 C24H25N5O3S MW 463.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N5O3S/c1-27-20(30)24(21(31)28(2)23(27)32)14-15-13-17(10-11-18(15)29-12-6-9-19(24)29)26-22(33)25-16-7-4-3-5-8-16/h3-5,7-8,10-11,13,19H,6,9,12,14H2,1-2H3,(H2,25,26,33)
InChIKey
DVWLLHZNAHOPNX-UHFFFAOYSA-N
Synonyms
904509-47-3
1(13dimethyl246trioxo112333a46octahydro2H5Hspiro(pyrimidine54pyrrolo(12a)quinolin)7yl)3phenylthiourea
1(13dimethyl246trioxo22333a456octahydro1H1Hspiro(pyrimidine54pyrrolo(12a)quinolin)7yl)3phenylthiourea
1(13dimethyl246trioxospiro(13diazinane54233a5tetrahydro1Hpyrrolo(12a)quinoline)7yl)3phenylthiourea
904509473
CN1C(=O)C2(CC3=C(C=CC(=C3)NC(=S)NC4=CC=CC=C4)N5C2CCC5)C(=O)N(C1=O)C
InChI=1SC24H25N5O3Sc12720(30)24(21(31)28(2)23(27)32)14151317(101118(15)29126919(24)29)2622(33)25167435816h357810111319H691214H212H3(H2252633)
MFCD07639771
ZINC000013591311
ZINC000013591313

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Available files

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