N-(2-methylprop-2-enyl)-4-(phenylcarbonyl)piperazine-1-carbothioamide

Systemtic Name: N-(2-methylprop-2-enyl)-4-(phenylcarbonyl)piperazine-1-carbothioamide Openeye Name: 4-benzoyl-N-(2-methylallyl)piperazine-1-carbothioamide CAS Name: 4-benzoyl-N-(2-methylprop-2-enyl)-1-piperazinecarbothioamide IUPAC Name: 4-benzoyl-N-(2-methylprop-2-enyl)piperazine-1-carbothioamide Traditional Name: 4-benzoyl-N-(2-methylallyl)piperazine-1-carbothioamide Formula: C16H21N3OS MolecularWeight: 303.42244

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CNC(=S)N1CCN(CC1)C(=O)C2=CC=CC=C2

Isomeric SMILES

CC(=C)CNC(=S)N1CCN(CC1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H21N3OS/c1-13(2)12-17-16(21)19-10-8-18(9-11-19)15(20)14-6-4-3-5-7-14/h3-7H,1,8-12H2,2H3,(H,17,21)