Vitas-M small molecule compound

(2E)-N-[(9,10-dioxo-9,10-dihydroanthracen-2-yl)carbamothioyl]-3-(thiophen-2-yl)prop-2-enamide

Catalog ID
STK329101
SMILES O=C(NC(=S)Nc1ccc2c(c1)C(=O)c1c(C2=O)cccc1)/C=C/c1cccs1

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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 C22H14N2O3S2 MW 418.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H14N2O3S2/c25-19(10-8-14-4-3-11-29-14)24-22(28)23-13-7-9-17-18(12-13)21(27)16-6-2-1-5-15(16)20(17)26/h1-12H,(H2,23,24,25,28)/b10-8+
InChIKey
ZEKCJAOREJRSAL-CSKARUKUSA-N
Synonyms
799799-74-9
(2E)N((910dioxo910dihydroanthracen2yl)carbamothioyl)3(thiophen2yl)prop2enamide
(E)N((910dioxo910dihydroanthracen2yl)carbamothioyl)3(thiophen2yl)acrylamide
(E)N((910DIOXOANTHRACEN2YL)CARBAMOTHIOYL)3THIOPHEN2YLPROP2ENAMIDE
799799749
C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)NC(=S)NC(=O)C=CC4=CC=CS4
InChI=1SC22H14N2O3S2c2519(1081443112914)2422(28)2313791718(1213)21(27)16621515(16)20(17)26h112H(H223242528)b108+
MFCD03678024
O=C(NC(=S)Nc1ccc2c(c1)C(=O)c1c(C2=O)cccc1)C=Cc1cccs1
ZINC000009427704
ZINC09427704
ZINC9427704

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Available files

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