Vitas-M small molecule compound
4-(furan-2-ylcarbonyl)-N-(2-methoxy-4-nitrophenyl)piperazine-1-carbothioamide
Catalog ID
STK455489
SMILES COc1cc(ccc1NC(=S)N1CCN(CC1)C(=O)c1ccco1)[N+](=O)[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 C17H18N4O5S MW 390.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4O5S/c1-25-15-11-12(21(23)24)4-5-13(15)18-17(27)20-8-6-19(7-9-20)16(22)14-3-2-10-26-14/h2-5,10-11H,6-9H2,1H3,(H,18,27)InChIKey
UQGADOJOHQEUDC-UHFFFAOYSA-NSynonyms
2FURYL4(((2METHOXY4NITROPHENYL)AMINO)THIOXOMETHYL)PIPERAZINYLKETONE
4(FURAN2CARBONYL)N(2METHOXY4NITROPHENYL)PIPERAZINE1CARBOTHIOAMIDE
4(furan2ylcarbonyl)N(2methoxy4nitrophenyl)piperazine1carbothioamide
COC1=C(C=CC(=C1)(N+)(=O)(O))NC(=S)N2CCN(CC2)C(=O)C3=CC=CO3
COc1cc(ccc1NC(=S)N1CCN(CC1)C(=O)c1ccco1)(N+)(=O)(O)
InChI=1SC17H18N4O5Sc125151112(21(23)24)4513(15)1817(27)208619(7920)16(22)1432102614h251011H69H21H3(H1827)
MFCD04137050
ZINC000005041705
ZINC05041705
ZINC5041705
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