(3R)-N-(3-ethanoylphenyl)-3-methyl-4-(4-methylphenyl)piperazine-1-carbothioamide

Systemtic Name: (3R)-N-(3-ethanoylphenyl)-3-methyl-4-(4-methylphenyl)piperazine-1-carbothioamide Openeye Name: (3R)-N-(3-acetylphenyl)-3-methyl-4-(p-tolyl)piperazine-1-carbothioamide CAS Name: (3R)-N-(3-acetylphenyl)-3-methyl-4-(4-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: (3R)-N-(3-acetylphenyl)-3-methyl-4-(4-methylphenyl)piperazine-1-carbothioamide Traditional Name: (3R)-N-(3-acetylphenyl)-3-methyl-4-(p-tolyl)piperazine-1-carbothioamide Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=C(C=C2)C)C(=S)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

C[C@@H]1CN(CCN1C2=CC=C(C=C2)C)C(=S)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C21H25N3OS/c1-15-7-9-20(10-8-15)24-12-11-23(14-16(24)2)21(26)22-19-6-4-5-18(13-19)17(3)25/h4-10,13,16H,11-12,14H2,1-3H3,(H,22,26)/t16-/m1/s1