N-(4-ethanoylphenyl)-4-phenethyl-piperazine-1-carbothioamide

Systemtic Name: N-(4-ethanoylphenyl)-4-phenethyl-piperazine-1-carbothioamide Openeye Name: N-(4-acetylphenyl)-4-phenethyl-piperazine-1-carbothioamide CAS Name: N-(4-acetylphenyl)-4-phenethyl-1-piperazinecarbothioamide IUPAC Name: N-(4-acetylphenyl)-4-phenethylpiperazine-1-carbothioamide Traditional Name: N-(4-acetylphenyl)-4-phenethyl-piperazine-1-carbothioamide Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)CCC3=CC=CC=C3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)NC(=S)N2CCN(CC2)CCC3=CC=CC=C3

InChI

InChI=1S/C21H25N3OS/c1-17(25)19-7-9-20(10-8-19)22-21(26)24-15-13-23(14-16-24)12-11-18-5-3-2-4-6-18/h2-10H,11-16H2,1H3,(H,22,26)