N-(4-butylphenyl)-4-cyclopropylcarbonyl-piperazine-1-carbothioamide

Systemtic Name: N-(4-butylphenyl)-4-cyclopropylcarbonyl-piperazine-1-carbothioamide Openeye Name: N-(4-butylphenyl)-4-(cyclopropanecarbonyl)piperazine-1-carbothioamide CAS Name: N-(4-butylphenyl)-4-[cyclopropyl(oxo)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(4-butylphenyl)-4-(cyclopropanecarbonyl)piperazine-1-carbothioamide Traditional Name: N-(4-butylphenyl)-4-(cyclopropanecarbonyl)piperazine-1-carbothioamide Formula: C19H27N3OS MolecularWeight: 345.50218

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C(=O)C3CC3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C(=O)C3CC3

InChI

InChI=1S/C19H27N3OS/c1-2-3-4-15-5-9-17(10-6-15)20-19(24)22-13-11-21(12-14-22)18(23)16-7-8-16/h5-6,9-10,16H,2-4,7-8,11-14H2,1H3,(H,20,24)