N-[2-(4-ethoxyphenyl)-1-phenyl-ethyl]-4-phenyl-piperazine-1-carbothioamide

Systemtic Name: N-[2-(4-ethoxyphenyl)-1-phenyl-ethyl]-4-phenyl-piperazine-1-carbothioamide Openeye Name: N-[2-(4-ethoxyphenyl)-1-phenyl-ethyl]-4-phenyl-piperazine-1-carbothioamide CAS Name: N-[2-(4-ethoxyphenyl)-1-phenylethyl]-4-phenyl-1-piperazinecarbothioamide IUPAC Name: N-[2-(4-ethoxyphenyl)-1-phenylethyl]-4-phenylpiperazine-1-carbothioamide Traditional Name: 4-phenyl-N-(1-phenyl-2-p-phenetyl-ethyl)piperazine-1-carbothioamide Formula: C27H31N3OS MolecularWeight: 445.61954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC(C2=CC=CC=C2)NC(=S)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)CC(C2=CC=CC=C2)NC(=S)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3OS/c1-2-31-25-15-13-22(14-16-25)21-26(23-9-5-3-6-10-23)28-27(32)30-19-17-29(18-20-30)24-11-7-4-8-12-24/h3-16,26H,2,17-21H2,1H3,(H,28,32)