(NE)-N-[(4-methylphenyl)-phenylazanyl-methylidene]-4-(phenylmethyl)piperazine-1-carbothioamide

Systemtic Name: (NE)-N-[(4-methylphenyl)-phenylazanyl-methylidene]-4-(phenylmethyl)piperazine-1-carbothioamide Openeye Name: (NE)-N-[anilino(p-tolyl)methylene]-4-benzyl-piperazine-1-carbothioamide CAS Name: (NE)-N-[anilino-(4-methylphenyl)methylidene]-4-(phenylmethyl)-1-piperazinecarbothioamide IUPAC Name: (NE)-N-[anilino-(4-methylphenyl)methylidene]-4-benzylpiperazine-1-carbothioamide Traditional Name: (NE)-N-[anilino(p-tolyl)methylene]-4-benzyl-piperazine-1-carbothioamide Formula: C26H28N4S MolecularWeight: 428.59232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=NC(=S)N2CCN(CC2)CC3=CC=CC=C3)NC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)/C(=N\C(=S)N2CCN(CC2)CC3=CC=CC=C3)/NC4=CC=CC=C4

InChI

InChI=1S/C26H28N4S/c1-21-12-14-23(15-13-21)25(27-24-10-6-3-7-11-24)28-26(31)30-18-16-29(17-19-30)20-22-8-4-2-5-9-22/h2-15H,16-20H2,1H3,(H,27,28,31)