4-(furan-2-ylcarbonyl)-N-(2-methoxy-4-nitro-phenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(furan-2-ylcarbonyl)-N-(2-methoxy-4-nitro-phenyl)piperazine-1-carbothioamide Openeye Name: 4-(furan-2-carbonyl)-N-(2-methoxy-4-nitro-phenyl)piperazine-1-carbothioamide CAS Name: 4-[2-furanyl(oxo)methyl]-N-(2-methoxy-4-nitrophenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(furan-2-carbonyl)-N-(2-methoxy-4-nitrophenyl)piperazine-1-carbothioamide Traditional Name: 4-(2-furoyl)-N-(2-methoxy-4-nitro-phenyl)piperazine-1-carbothioamide Formula: C17H18N4O5S MolecularWeight: 390.41362

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)N2CCN(CC2)C(=O)C3=CC=CO3

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)N2CCN(CC2)C(=O)C3=CC=CO3

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)