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

Systemtic Name: 4-(4-ethanoylphenyl)-N-(4-ethoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-(4-acetylphenyl)-N-(4-ethoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-(4-acetylphenyl)-N-(4-ethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-acetylphenyl)-N-(4-ethoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-(4-acetylphenyl)-N-p-phenetyl-piperazine-1-carbothioamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H25N3O2S/c1-3-26-20-10-6-18(7-11-20)22-21(27)24-14-12-23(13-15-24)19-8-4-17(5-9-19)16(2)25/h4-11H,3,12-15H2,1-2H3,(H,22,27)