N-(3-methoxypropyl)-4-(phenylcarbonyl)piperazine-1-carbothioamide

Systemtic Name: N-(3-methoxypropyl)-4-(phenylcarbonyl)piperazine-1-carbothioamide Openeye Name: 4-benzoyl-N-(3-methoxypropyl)piperazine-1-carbothioamide CAS Name: 4-benzoyl-N-(3-methoxypropyl)-1-piperazinecarbothioamide IUPAC Name: 4-benzoyl-N-(3-methoxypropyl)piperazine-1-carbothioamide Traditional Name: 4-benzoyl-N-(3-methoxypropyl)piperazine-1-carbothioamide Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O2S/c1-21-13-5-8-17-16(22)19-11-9-18(10-12-19)15(20)14-6-3-2-4-7-14/h2-4,6-7H,5,8-13H2,1H3,(H,17,22)