4-(3-methoxyphenyl)-N-(2-methylpropyl)piperazine-1-carbothioamide

Systemtic Name: 4-(3-methoxyphenyl)-N-(2-methylpropyl)piperazine-1-carbothioamide Openeye Name: N-isobutyl-4-(3-methoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-(3-methoxyphenyl)-N-(2-methylpropyl)-1-piperazinecarbothioamide IUPAC Name: 4-(3-methoxyphenyl)-N-(2-methylpropyl)piperazine-1-carbothioamide Traditional Name: N-isobutyl-4-(3-methoxyphenyl)piperazine-1-carbothioamide Formula: C16H25N3OS MolecularWeight: 307.4542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25N3OS/c1-13(2)12-17-16(21)19-9-7-18(8-10-19)14-5-4-6-15(11-14)20-3/h4-6,11,13H,7-10,12H2,1-3H3,(H,17,21)