phenacyl N-phenyl-4-(phenylmethyl)piperazine-1-carboximidothioate

Systemtic Name: phenacyl N-phenyl-4-(phenylmethyl)piperazine-1-carboximidothioate Openeye Name: phenacyl 4-benzyl-N-phenyl-piperazine-1-carboximidothioate CAS Name: N-phenyl-4-(phenylmethyl)-1-piperazinecarboximidothioic acid phenacyl ester IUPAC Name: phenacyl 4-benzyl-N-phenylpiperazine-1-carboximidothioate Traditional Name: 4-benzyl-N-phenyl-piperazine-1-carboximidothioic acid phenacyl ester Formula: C26H27N3OS MolecularWeight: 429.57708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=NC3=CC=CC=C3)SCC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=NC3=CC=CC=C3)SCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H27N3OS/c30-25(23-12-6-2-7-13-23)21-31-26(27-24-14-8-3-9-15-24)29-18-16-28(17-19-29)20-22-10-4-1-5-11-22/h1-15H,16-21H2