4-[(4-chlorophenyl)-phenyl-methyl]-N-(4-ethoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[(4-chlorophenyl)-phenyl-methyl]-N-(4-ethoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-[(4-chlorophenyl)-phenyl-methyl]-N-(4-ethoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-[(4-chlorophenyl)-phenylmethyl]-N-(4-ethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[(4-chlorophenyl)-phenylmethyl]-N-(4-ethoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-[(4-chlorophenyl)-phenyl-methyl]-N-p-phenetyl-piperazine-1-carbothioamide Formula: C26H28ClN3OS MolecularWeight: 466.03802

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H28ClN3OS/c1-2-31-24-14-12-23(13-15-24)28-26(32)30-18-16-29(17-19-30)25(20-6-4-3-5-7-20)21-8-10-22(27)11-9-21/h3-15,25H,2,16-19H2,1H3,(H,28,32)