4-cyclopropylcarbonyl-N-(2-methylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-cyclopropylcarbonyl-N-(2-methylphenyl)piperazine-1-carbothioamide Openeye Name: 4-(cyclopropanecarbonyl)-N-(o-tolyl)piperazine-1-carbothioamide CAS Name: 4-[cyclopropyl(oxo)methyl]-N-(2-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(cyclopropanecarbonyl)-N-(2-methylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(cyclopropanecarbonyl)-N-(o-tolyl)piperazine-1-carbothioamide Formula: C16H21N3OS MolecularWeight: 303.42244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)N2CCN(CC2)C(=O)C3CC3

Isomeric SMILES

CC1=CC=CC=C1NC(=S)N2CCN(CC2)C(=O)C3CC3

InChI

InChI=1S/C16H21N3OS/c1-12-4-2-3-5-14(12)17-16(21)19-10-8-18(9-11-19)15(20)13-6-7-13/h2-5,13H,6-11H2,1H3,(H,17,21)