N-(4-butan-2-ylphenyl)-4-(furan-2-ylcarbonyl)piperazine-1-carbothioamide

Systemtic Name: N-(4-butan-2-ylphenyl)-4-(furan-2-ylcarbonyl)piperazine-1-carbothioamide Openeye Name: 4-(furan-2-carbonyl)-N-(4-sec-butylphenyl)piperazine-1-carbothioamide CAS Name: N-(4-butan-2-ylphenyl)-4-[2-furanyl(oxo)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(4-butan-2-ylphenyl)-4-(furan-2-carbonyl)piperazine-1-carbothioamide Traditional Name: 4-(2-furoyl)-N-(4-sec-butylphenyl)piperazine-1-carbothioamide Formula: C20H25N3O2S MolecularWeight: 371.4964

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O2S/c1-3-15(2)16-6-8-17(9-7-16)21-20(26)23-12-10-22(11-13-23)19(24)18-5-4-14-25-18/h4-9,14-15H,3,10-13H2,1-2H3,(H,21,26)