Vitas-M small molecule compound

methyl 4-({[4-(furan-2-ylcarbonyl)piperazin-1-yl]carbonothioyl}amino)benzoate

Catalog ID
STK164911
SMILES COC(=O)c1ccc(cc1)NC(=S)N1CCN(CC1)C(=O)c1ccco1

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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 C18H19N3O4S MW 373.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O4S/c1-24-17(23)13-4-6-14(7-5-13)19-18(26)21-10-8-20(9-11-21)16(22)15-3-2-12-25-15/h2-7,12H,8-11H2,1H3,(H,19,26)
InChIKey
ZMBHSWAHVTVPQN-UHFFFAOYSA-N
Synonyms

COC(=O)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)C(=O)C3=CC=CO3
InChI=1SC18H19N3O4Sc12417(23)134614(7513)1918(26)2110820(91121)16(22)1532122515h2712H811H21H3(H1926)
METHYL4(((4(2FURYLCARBONYL)PIPERAZINYL)THIOXOMETHYL)AMINO)BENZOATE
METHYL4(((4(FURAN2YLCARBONYL)PIPERAZIN1YL)CARBONOTHIOYL)AMINO)BENZOATE
METHYL4((4(FURAN2CARBONYL)PIPERAZINE1CARBOTHIOYL)AMINO)BENZOATE
MFCD05992949
ZINC000002342654
ZINC02342654
ZINC2342654

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Available files

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