Vitas-M small molecule compound

N-(4-chlorophenyl)-2-[(3Z)-3-(3-dodecyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-2-oxo-2,3-dihydro-1H-indol-1-yl]acetamide

Catalog ID
STK814024
SMILES CCCCCCCCCCCCN1C(=S)S/C(=C\2/c3ccccc3N(C2=O)CC(=O)Nc2ccc(cc2)Cl)/C1=O

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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 C31H36ClN3O3S2 MW 598.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H36ClN3O3S2/c1-2-3-4-5-6-7-8-9-10-13-20-34-30(38)28(40-31(34)39)27-24-14-11-12-15-25(24)35(29(27)37)21-26(36)33-23-18-16-22(32)17-19-23/h11-12,14-19H,2-10,13,20-21H2,1H3,(H,33,36)/b28-27-
InChIKey
PYOXULQVUWAHQY-DQSJHHFOSA-N
Synonyms
618075-49-3
618075493
CCCCCCCCCCCCN1C(=O)C(=C2C3=CC=CC=C3N(C2=O)CC(=O)NC4=CC=C(C=C4)Cl)SC1=S
CCCCCCCCCCCCN1C(=S)SC(=C2c3ccccc3N(C2=O)CC(=O)Nc2ccc(cc2)Cl)C1=O
InChI=1SC31H36ClN3O3S2c1234567891013203430(38)28(4031(34)39)27241411121525(24)35(29(27)37)2126(36)3323181622(32)171923h11121419H210132021H21H3(H3336)b2827
MFCD03535353
N(4CHLOROPHENYL)2((3Z)3(3DODECYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)2OXOINDOL1YL)ACETAMIDE
N(4chlorophenyl)2((3Z)3(3dodecyl4oxo2thioxo13thiazolidin5ylidene)2oxo23dihydro1Hindol1yl)acetamide
N(4CHLOROPHENYL)2(3(3DODECYL4OXO2THIOXOTHIAZOLIDIN5YLIDENE)2OXOINDOLIN1YL)ACETAMIDE
ZINC000100872015
ZINC100872015

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Available files

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