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

Systemtic Name: 4-(4-ethanoylphenyl)-N-(3-ethylphenyl)piperazine-1-carbothioamide Openeye Name: 4-(4-acetylphenyl)-N-(3-ethylphenyl)piperazine-1-carbothioamide CAS Name: 4-(4-acetylphenyl)-N-(3-ethylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-acetylphenyl)-N-(3-ethylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(4-acetylphenyl)-N-(3-ethylphenyl)piperazine-1-carbothioamide Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H25N3OS/c1-3-17-5-4-6-19(15-17)22-21(26)24-13-11-23(12-14-24)20-9-7-18(8-10-20)16(2)25/h4-10,15H,3,11-14H2,1-2H3,(H,22,26)