Vitas-M small molecule compound

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

Catalog ID
STK880613
SMILES CCCCCCCN1C(=S)S/C(=C\2/c3ccccc3N(C2=O)CC(=O)Nc2ccc(cc2C)C)/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 C28H31N3O3S2 MW 521.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N3O3S2/c1-4-5-6-7-10-15-30-27(34)25(36-28(30)35)24-20-11-8-9-12-22(20)31(26(24)33)17-23(32)29-21-14-13-18(2)16-19(21)3/h8-9,11-14,16H,4-7,10,15,17H2,1-3H3,(H,29,32)/b25-24-
InChIKey
DRTXKDHZVXOITH-IZHYLOQSSA-N
Synonyms
617694-11-8
617694118
CCCCCCCN1C(=O)C(=C2C3=CC=CC=C3N(C2=O)CC(=O)NC4=C(C=C(C=C4)C)C)SC1=S
CCCCCCCN1C(=S)SC(=C2c3ccccc3N(C2=O)CC(=O)Nc2ccc(cc2C)C)C1=O
InChI=1SC28H31N3O3S2c1456710153027(34)25(3628(30)35)242011891222(20)31(26(24)33)1723(32)2921141318(2)1619(21)3h89111416H47101517H213H3(H2932)b2524
MFCD04441245
N(24DIMETHYLPHENYL)2((3Z)3(3HEPTYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)2OXOINDOL1YL)ACETAMIDE
N(24dimethylphenyl)2((3Z)3(3heptyl4oxo2thioxo13thiazolidin5ylidene)2oxo23dihydro1Hindol1yl)acetamide
N(24DIMETHYLPHENYL)2(3(3HEPTYL4OXO2THIOXOTHIAZOLIDIN5YLIDENE)2OXOINDOLIN1YL)ACETAMIDE
ZINC000100870948
ZINC100870948

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Available files

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