N-(3-methylphenyl)-4-phenyl-piperazine-1-carbothioamide

Systemtic Name: N-(3-methylphenyl)-4-phenyl-piperazine-1-carbothioamide Openeye Name: N-(m-tolyl)-4-phenyl-piperazine-1-carbothioamide CAS Name: N-(3-methylphenyl)-4-phenyl-1-piperazinecarbothioamide IUPAC Name: N-(3-methylphenyl)-4-phenylpiperazine-1-carbothioamide Traditional Name: N-(m-tolyl)-4-phenyl-piperazine-1-carbothioamide Formula: C18H21N3S MolecularWeight: 311.44444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3S/c1-15-6-5-7-16(14-15)19-18(22)21-12-10-20(11-13-21)17-8-3-2-4-9-17/h2-9,14H,10-13H2,1H3,(H,19,22)