Vitas-M small molecule compound

methyl 4-({[(3Z)-2-oxo-3-(4-oxo-3-propyl-2-thioxo-1,3-thiazolidin-5-ylidene)-2,3-dihydro-1H-indol-1-yl]acetyl}amino)benzoate

Catalog ID
STK880563
SMILES CCCN1C(=S)S/C(=C\2/c3ccccc3N(C2=O)CC(=O)Nc2ccc(cc2)C(=O)OC)/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 C24H21N3O5S2 MW 495.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N3O5S2/c1-3-12-26-22(30)20(34-24(26)33)19-16-6-4-5-7-17(16)27(21(19)29)13-18(28)25-15-10-8-14(9-11-15)23(31)32-2/h4-11H,3,12-13H2,1-2H3,(H,25,28)/b20-19-
InChIKey
PCJYRMLTKJNEGS-VXPUYCOJSA-N
Synonyms
609796-92-1
609796921
CCCN1C(=O)C(=C2C3=CC=CC=C3N(C2=O)CC(=O)NC4=CC=C(C=C4)C(=O)OC)SC1=S
CCCN1C(=S)SC(=C2c3ccccc3N(C2=O)CC(=O)Nc2ccc(cc2)C(=O)OC)C1=O
InChI=1SC24H21N3O5S2c13122622(30)20(3424(26)33)1916645717(16)27(21(19)29)1318(28)251510814(91115)23(31)322h411H31213H212H3(H2528)b2019
methyl4((((3Z)2oxo3(4oxo3propyl2thioxo13thiazolidin5ylidene)23dihydro1Hindol1yl)acetyl)amino)benzoate
METHYL4((2((3Z)2OXO3(4OXO3PROPYL2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)INDOL1YL)ACETYL)AMINO)BENZOATE
METHYL4(2(2OXO3(4OXO3PROPYL2THIOXOTHIAZOLIDIN5YLIDENE)INDOLIN1YL)ACETAMIDO)BENZOATE
MFCD04441210
ZINC000016729580
ZINC16729580

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Available files

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