N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]-2-(thiophen-2-ylmethylsulfanyl)benzamide

Systemtic Name: N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]-2-(thiophen-2-ylmethylsulfanyl)benzamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-(2-thienylmethylsulfanyl)benzamide CAS Name: N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]-2-(thiophen-2-ylmethylthio)benzamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-2-(thiophen-2-ylmethylsulfanyl)benzamide Traditional Name: N-[4-(4-benzylpiperazino)phenyl]-2-(2-thenylthio)benzamide Formula: C29H29N3OS2 MolecularWeight: 499.69006

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4SCC5=CC=CS5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4SCC5=CC=CS5

InChI

InChI=1S/C29H29N3OS2/c33-29(27-10-4-5-11-28(27)35-22-26-9-6-20-34-26)30-24-12-14-25(15-13-24)32-18-16-31(17-19-32)21-23-7-2-1-3-8-23/h1-15,20H,16-19,21-22H2,(H,30,33)