Vitas-M small molecule compound

ethyl 5-{[(E)-{[4-(acetylamino)phenyl]amino}methylidene]amino}-1,2,3-thiadiazole-4-carboxylate

Catalog ID
STL438014
SMILES CCOC(=O)c1nnsc1/N=C/Nc1ccc(cc1)NC(=O)C

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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 C14H15N5O3S MW 333.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15N5O3S/c1-3-22-14(21)12-13(23-19-18-12)16-8-15-10-4-6-11(7-5-10)17-9(2)20/h4-8H,3H2,1-2H3,(H,15,16)(H,17,20)
InChIKey
MHRDLTTWAAOQRM-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SN=N1)N=CNC2=CC=C(C=C2)NC(=O)C
CCOC(=O)c1nnsc1N=CNc1ccc(cc1)NC(=O)C
ETHYL5(((1E)((4(ACETYLAMINO)PHENYL)AMINO)METHYLENE)AMINO)123THIADIAZOLE4CARBOXYLATE
ethyl5(((E)((4(acetylamino)phenyl)amino)methylidene)amino)123thiadiazole4carboxylate
ETHYL5((4ACETAMIDOANILINO)METHYLIDENEAMINO)THIADIAZOLE4CARBOXYLATE
InChI=1SC14H15N5O3Sc132214(21)1213(23191812)16815104611(7510)179(2)20h48H3H212H3(H1516)(H1720)
MFCD06242384
ZINC000004477824
ZINC4477824

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Available files

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