N-(3-ethanoylphenyl)-4-(4-hydroxyphenyl)piperazine-1-carbothioamide

Systemtic Name: N-(3-ethanoylphenyl)-4-(4-hydroxyphenyl)piperazine-1-carbothioamide Openeye Name: N-(3-acetylphenyl)-4-(4-hydroxyphenyl)piperazine-1-carbothioamide CAS Name: N-(3-acetylphenyl)-4-(4-hydroxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N-(3-acetylphenyl)-4-(4-hydroxyphenyl)piperazine-1-carbothioamide Traditional Name: N-(3-acetylphenyl)-4-(4-hydroxyphenyl)piperazine-1-carbothioamide Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O2S/c1-14(23)15-3-2-4-16(13-15)20-19(25)22-11-9-21(10-12-22)17-5-7-18(24)8-6-17/h2-8,13,24H,9-12H2,1H3,(H,20,25)