(5S)-2-phenyl-5-(4-phenylpiperazin-1-yl)-4,5,6,7-tetrahydro-1H-1,3-diazepine

Systemtic Name: (5S)-2-phenyl-5-(4-phenylpiperazin-1-yl)-4,5,6,7-tetrahydro-1H-1,3-diazepine Openeye Name: (5S)-2-phenyl-5-(4-phenylpiperazin-1-yl)-4,5,6,7-tetrahydro-1H-1,3-diazepine CAS Name: (5S)-2-phenyl-5-(4-phenyl-1-piperazinyl)-4,5,6,7-tetrahydro-1H-1,3-diazepine IUPAC Name: (5S)-2-phenyl-5-(4-phenylpiperazin-1-yl)-4,5,6,7-tetrahydro-1H-1,3-diazepine Traditional Name: (5S)-2-phenyl-5-(4-phenylpiperazino)-4,5,6,7-tetrahydro-1H-1,3-diazepine Formula: C21H26N4 MolecularWeight: 334.45794

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=NCC1N2CCN(CC2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CNC(=NC[C@H]1N2CCN(CC2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H26N4/c1-3-7-18(8-4-1)21-22-12-11-20(17-23-21)25-15-13-24(14-16-25)19-9-5-2-6-10-19/h1-10,20H,11-17H2,(H,22,23)/t20-/m0/s1