2-chloranyl-N-[4-[[5-[4-(phenylmethyl)piperazin-1-yl]-2,3,4,5-tetrahydro-1-benzazepin-1-yl]carbonyl]phenyl]benzamide

Systemtic Name: 2-chloranyl-N-[4-[[5-[4-(phenylmethyl)piperazin-1-yl]-2,3,4,5-tetrahydro-1-benzazepin-1-yl]carbonyl]phenyl]benzamide Openeye Name: N-[4-[5-(4-benzylpiperazin-1-yl)-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]phenyl]-2-chloro-benzamide CAS Name: 2-chloro-N-[4-[oxo-[5-[4-(phenylmethyl)-1-piperazinyl]-2,3,4,5-tetrahydro-1-benzazepin-1-yl]methyl]phenyl]benzamide IUPAC Name: N-[4-[5-(4-benzylpiperazin-1-yl)-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]phenyl]-2-chlorobenzamide Traditional Name: N-[4-[5-(4-benzylpiperazino)-2,3,4,5-tetrahydro-1-benzazepine-1-carbonyl]phenyl]-2-chloro-benzamide Formula: C35H35ClN4O2 MolecularWeight: 579.131

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=CC=CC=C2N(C1)C(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4Cl)N5CCN(CC5)CC6=CC=CC=C6

Isomeric SMILES

C1CC(C2=CC=CC=C2N(C1)C(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4Cl)N5CCN(CC5)CC6=CC=CC=C6

InChI

InChI=1S/C35H35ClN4O2/c36-31-13-6-4-11-29(31)34(41)37-28-18-16-27(17-19-28)35(42)40-20-8-15-32(30-12-5-7-14-33(30)40)39-23-21-38(22-24-39)25-26-9-2-1-3-10-26/h1-7,9-14,16-19,32H,8,15,20-25H2,(H,37,41)