N,N-diethyl-4-[(S)-[3-[(phenylmethyl)amino]phenyl]-piperazin-1-yl-methyl]benzamide

Systemtic Name: N,N-diethyl-4-[(S)-[3-[(phenylmethyl)amino]phenyl]-piperazin-1-yl-methyl]benzamide Openeye Name: 4-[(S)-[3-(benzylamino)phenyl]-piperazin-1-yl-methyl]-N,N-diethyl-benzamide CAS Name: N,N-diethyl-4-[(S)-[3-[(phenylmethyl)amino]phenyl]-(1-piperazinyl)methyl]benzamide IUPAC Name: 4-[(S)-[3-(benzylamino)phenyl]-piperazin-1-ylmethyl]-N,N-diethylbenzamide Traditional Name: 4-[(S)-[3-(benzylamino)phenyl]-piperazino-methyl]-N,N-diethyl-benzamide Formula: C29H36N4O MolecularWeight: 456.62234

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C(C2=CC(=CC=C2)NCC3=CC=CC=C3)N4CCNCC4

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)[C@@H](C2=CC(=CC=C2)NCC3=CC=CC=C3)N4CCNCC4

InChI

InChI=1S/C29H36N4O/c1-3-32(4-2)29(34)25-15-13-24(14-16-25)28(33-19-17-30-18-20-33)26-11-8-12-27(21-26)31-22-23-9-6-5-7-10-23/h5-16,21,28,30-31H,3-4,17-20,22H2,1-2H3/t28-/m0/s1