(2S)-N-(2,5-dimethylphenyl)-4-methyl-2-phenyl-piperazine-1-carbothioamide

Systemtic Name: (2S)-N-(2,5-dimethylphenyl)-4-methyl-2-phenyl-piperazine-1-carbothioamide Openeye Name: (2S)-N-(2,5-dimethylphenyl)-4-methyl-2-phenyl-piperazine-1-carbothioamide CAS Name: (2S)-N-(2,5-dimethylphenyl)-4-methyl-2-phenyl-1-piperazinecarbothioamide IUPAC Name: (2S)-N-(2,5-dimethylphenyl)-4-methyl-2-phenylpiperazine-1-carbothioamide Traditional Name: (2S)-N-(2,5-dimethylphenyl)-4-methyl-2-phenyl-piperazine-1-carbothioamide Formula: C20H25N3S MolecularWeight: 339.4976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)N2CCN(CC2C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)N2CCN(C[C@@H]2C3=CC=CC=C3)C

InChI

InChI=1S/C20H25N3S/c1-15-9-10-16(2)18(13-15)21-20(24)23-12-11-22(3)14-19(23)17-7-5-4-6-8-17/h4-10,13,19H,11-12,14H2,1-3H3,(H,21,24)/t19-/m1/s1