Vitas-M small molecule compound

N-(1,1-dioxidotetrahydrothiophen-3-yl)-N-methyl-4-[(5Z)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]butanamide

Catalog ID
STK614461
SMILES O=C(N(C1CCS(=O)(=O)C1)C)CCCN1C(=S)S/C(=C\c2cccs2)/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 C17H20N2O4S4 MW 444.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N2O4S4/c1-18(12-6-9-27(22,23)11-12)15(20)5-2-7-19-16(21)14(26-17(19)24)10-13-4-3-8-25-13/h3-4,8,10,12H,2,5-7,9,11H2,1H3/b14-10-
InChIKey
UMMNNRHHTYEDNG-UVTDQMKNSA-N
Synonyms
902026-88-4
(Z)N(11dioxidotetrahydrothiophen3yl)Nmethyl4(4oxo5(thiophen2ylmethylene)2thioxothiazolidin3yl)butanamide
902026884
CN(C1CCS(=O)(=O)C1)C(=O)CCCN2C(=O)C(=CC3=CC=CS3)SC2=S
InChI=1SC17H20N2O4S4c118(126927(2223)1112)15(20)5271916(21)14(2617(19)24)10134382513h3481012H257911H21H3b1410
MFCD06786859
N(11dioxidotetrahydrothiophen3yl)Nmethyl4((5Z)4oxo5(thiophen2ylmethylidene)2thioxo13thiazolidin3yl)butanamide
N(11dioxothiolan3yl)Nmethyl4((5Z)4oxo2sulfanylidene5(thiophen2ylmethylidene)13thiazolidin3yl)butanamide
O=C(N(C1CCS(=O)(=O)C1)C)CCCN1C(=S)SC(=Cc2cccs2)C1=O
ZINC000009253725
ZINC000009253728

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Available files

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