Vitas-M small molecule compound

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

Catalog ID
STK813312
SMILES CCCCCCCN1C(=S)S/C(=C\2/c3ccccc3N(C2=O)CC(=O)Nc2ccc(cc2)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 C27H29N3O4S2 MW 523.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O4S2/c1-3-4-5-6-9-16-29-26(33)24(36-27(29)35)23-20-10-7-8-11-21(20)30(25(23)32)17-22(31)28-18-12-14-19(34-2)15-13-18/h7-8,10-15H,3-6,9,16-17H2,1-2H3,(H,28,31)/b24-23-
InChIKey
KDAAWTLOIQPXEB-VHXPQNKSSA-N
Synonyms
617696-43-2
2((3Z)3(3HEPTYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)2OXOINDOL1YL)N(4METHOXYPHENYL)ACETAMIDE
2((3Z)3(3heptyl4oxo2thioxo13thiazolidin5ylidene)2oxo23dihydro1Hindol1yl)N(4methoxyphenyl)acetamide
2(3(3HEPTYL4OXO2THIOXOTHIAZOLIDIN5YLIDENE)2OXOINDOLIN1YL)N(4METHOXYPHENYL)ACETAMIDE
617696432
CCCCCCCN1C(=O)C(=C2C3=CC=CC=C3N(C2=O)CC(=O)NC4=CC=C(C=C4)OC)SC1=S
CCCCCCCN1C(=S)SC(=C2c3ccccc3N(C2=O)CC(=O)Nc2ccc(cc2)OC)C1=O
InChI=1SC27H29N3O4S2c134569162926(33)24(3627(29)35)232010781121(20)30(25(23)32)1722(31)2818121419(342)151318h781015H3691617H212H3(H2831)b2423
MFCD04441485
ZINC000100871314
ZINC100871314

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Available files

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