N-(2,3-dimethylphenyl)-4-(4-ethanoylphenyl)piperazine-1-carbothioamide

Systemtic Name: N-(2,3-dimethylphenyl)-4-(4-ethanoylphenyl)piperazine-1-carbothioamide Openeye Name: 4-(4-acetylphenyl)-N-(2,3-dimethylphenyl)piperazine-1-carbothioamide CAS Name: 4-(4-acetylphenyl)-N-(2,3-dimethylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-acetylphenyl)-N-(2,3-dimethylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(4-acetylphenyl)-N-(2,3-dimethylphenyl)piperazine-1-carbothioamide Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)C(=O)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=S)N2CCN(CC2)C3=CC=C(C=C3)C(=O)C)C

InChI

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