Vitas-M small molecule compound

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

Catalog ID
STK813442
SMILES CCCCCCN1C(=S)S/C(=C\2/c3ccccc3N(C2=O)CC(=O)Nc2ccc(cc2OC)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 C27H29N3O5S2 MW 539.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O5S2/c1-4-5-6-9-14-29-26(33)24(37-27(29)36)23-18-10-7-8-11-20(18)30(25(23)32)16-22(31)28-19-13-12-17(34-2)15-21(19)35-3/h7-8,10-13,15H,4-6,9,14,16H2,1-3H3,(H,28,31)/b24-23-
InChIKey
PLBGHTDCWHOTAL-VHXPQNKSSA-N
Synonyms
617697-24-2
617697242
CCCCCCN1C(=O)C(=C2C3=CC=CC=C3N(C2=O)CC(=O)NC4=C(C=C(C=C4)OC)OC)SC1=S
CCCCCCN1C(=S)SC(=C2c3ccccc3N(C2=O)CC(=O)Nc2ccc(cc2OC)OC)C1=O
InChI=1SC27H29N3O5S2c14569142926(33)24(3727(29)36)231810781120(18)30(25(23)32)1622(31)2819131217(342)1521(19)353h78101315H4691416H213H3(H2831)b2423
MFCD04441562
N(24DIMETHOXYPHENYL)2((3Z)3(3HEXYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)2OXOINDOL1YL)ACETAMIDE
N(24dimethoxyphenyl)2((3Z)3(3hexyl4oxo2thioxo13thiazolidin5ylidene)2oxo23dihydro1Hindol1yl)acetamide
N(24DIMETHOXYPHENYL)2(3(3HEXYL4OXO2THIOXOTHIAZOLIDIN5YLIDENE)2OXOINDOLIN1YL)ACETAMIDE
ZINC000100871454
ZINC100871454

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Available files

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