(2S)-N-(3-fluoranyl-4-methyl-phenyl)-4-methyl-2-phenyl-piperazine-1-carbothioamide

Systemtic Name: (2S)-N-(3-fluoranyl-4-methyl-phenyl)-4-methyl-2-phenyl-piperazine-1-carbothioamide Openeye Name: (2S)-N-(3-fluoro-4-methyl-phenyl)-4-methyl-2-phenyl-piperazine-1-carbothioamide CAS Name: (2S)-N-(3-fluoro-4-methylphenyl)-4-methyl-2-phenyl-1-piperazinecarbothioamide IUPAC Name: (2S)-N-(3-fluoro-4-methylphenyl)-4-methyl-2-phenylpiperazine-1-carbothioamide Traditional Name: (2S)-N-(3-fluoro-4-methyl-phenyl)-4-methyl-2-phenyl-piperazine-1-carbothioamide Formula: C19H22FN3S MolecularWeight: 343.461483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22FN3S/c1-14-8-9-16(12-17(14)20)21-19(24)23-11-10-22(2)13-18(23)15-6-4-3-5-7-15/h3-9,12,18H,10-11,13H2,1-2H3,(H,21,24)/t18-/m1/s1