Vitas-M small molecule compound

N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-3-[(5Z)-5-(3-methoxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]propanamide

Catalog ID
STL035303
SMILES COc1cccc(c1)/C=C/1\SC(=O)N(C1=O)CCC(=O)Nc1c(=O)n(n(c1C)C)c1ccccc1

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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 C25H24N4O5S MW 492.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O5S/c1-16-22(24(32)29(27(16)2)18-9-5-4-6-10-18)26-21(30)12-13-28-23(31)20(35-25(28)33)15-17-8-7-11-19(14-17)34-3/h4-11,14-15H,12-13H2,1-3H3,(H,26,30)/b20-15-
InChIKey
HHKYJPMYXDUDJS-HKWRFOASSA-N
Synonyms

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CCN3C(=O)C(=CC4=CC(=CC=C4)OC)SC3=O
COc1cccc(c1)C=C1SC(=O)N(C1=O)CCC(=O)Nc1c(=O)n(n(c1C)C)c1ccccc1
InChI=1SC25H24N4O5Sc11622(24(32)29(27(16)2)1895461018)2621(30)12132823(31)20(3525(28)33)1517871119(1417)343h4111415H1213H213H3(H2630)b2015
MFCD01035383
N(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)3((5Z)5(3methoxybenzylidene)24dioxo13thiazolidin3yl)propanamide
N(15DIMETHYL3OXO2PHENYLPYRAZOL4YL)3((5Z)5((3METHOXYPHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)PROPANAMIDE
N(23DIMETHYL5OXO1PHENYL(3PYRAZOLIN4YL))3(5((3METHOXYPHENYL)METHYLENE)24DIOXO(13THIAZOLIDIN3YL))PROPANAMIDE
ZINC000001216374
ZINC01216374
ZINC1216374

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.