N-(3,5-dimethylphenyl)-4-(furan-2-ylcarbonyl)piperazine-1-carbothioamide

Systemtic Name: N-(3,5-dimethylphenyl)-4-(furan-2-ylcarbonyl)piperazine-1-carbothioamide Openeye Name: N-(3,5-dimethylphenyl)-4-(furan-2-carbonyl)piperazine-1-carbothioamide CAS Name: N-(3,5-dimethylphenyl)-4-[2-furanyl(oxo)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(3,5-dimethylphenyl)-4-(furan-2-carbonyl)piperazine-1-carbothioamide Traditional Name: N-(3,5-dimethylphenyl)-4-(2-furoyl)piperazine-1-carbothioamide Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)N2CCN(CC2)C(=O)C3=CC=CO3)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)N2CCN(CC2)C(=O)C3=CC=CO3)C

InChI

InChI=1S/C18H21N3O2S/c1-13-10-14(2)12-15(11-13)19-18(24)21-7-5-20(6-8-21)17(22)16-4-3-9-23-16/h3-4,9-12H,5-8H2,1-2H3,(H,19,24)