Vitas-M small molecule compound
ethyl 4-({[4-(tetrahydrofuran-2-ylcarbonyl)piperazin-1-yl]carbonothioyl}amino)benzoate
Catalog ID
STK050315
SMILES CCOC(=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 C19H25N3O4S MW 391.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25N3O4S/c1-2-25-18(24)14-5-7-15(8-6-14)20-19(27)22-11-9-21(10-12-22)17(23)16-4-3-13-26-16/h5-8,16H,2-4,9-13H2,1H3,(H,20,27)InChIKey
AGKUBNXBWJATNW-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)C(=O)C3CCCO3
ETHYL4(((4((2S)TETRAHYDROFURAN2YLCARBONYL)PIPERAZIN1YL)CARBOTHIOYL)AMINO)BENZOATE
ETHYL4(((4(OXOLAN2YLCARBONYL)PIPERAZINYL)THIOXOMETHYL)AMINO)BENZOATE
ETHYL4(((4(TETRAHYDRO2FURANYLCARBONYL)1PIPERAZINYL)CARBOTHIOYL)AMINO)BENZOATE
ETHYL4(((4(TETRAHYDROFURAN2YLCARBONYL)PIPERAZIN1YL)CARBONOTHIOYL)AMINO)BENZOATE
ETHYL4((4(OXOLANE2CARBONYL)PIPERAZINE1CARBOTHIOYL)AMINO)BENZOATE
InChI=1SC19H25N3O4Sc122518(24)145715(8614)2019(27)2211921(101222)17(23)1643132616h5816H24913H21H3(H2027)
MFCD03352549
STK050315
ZINC000000986485
ZINC000000986486
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