N-(6,11-dihydrobenzo[c][1]benzothiepin-11-yl)-4-(4-phenylpiperazin-1-yl)butanamide

Systemtic Name: N-(6,11-dihydrobenzo[c][1]benzothiepin-11-yl)-4-(4-phenylpiperazin-1-yl)butanamide Openeye Name: N-(6,11-dihydrobenzo[c][1]benzothiepin-11-yl)-4-(4-phenylpiperazin-1-yl)butanamide CAS Name: N-(6,11-dihydrobenzo[c][1]benzothiepin-11-yl)-4-(4-phenyl-1-piperazinyl)butanamide IUPAC Name: N-(6,11-dihydrobenzo[c][1]benzothiepin-11-yl)-4-(4-phenylpiperazin-1-yl)butanamide Traditional Name: N-(6,11-dihydrobenzo[c][1]benzothiepin-11-yl)-4-(4-phenylpiperazino)butyramide Formula: C28H31N3OS MolecularWeight: 457.63024

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC(=O)NC2C3=CC=CC=C3CSC4=CC=CC=C24)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCCC(=O)NC2C3=CC=CC=C3CSC4=CC=CC=C24)C5=CC=CC=C5

InChI

InChI=1S/C28H31N3OS/c32-27(15-8-16-30-17-19-31(20-18-30)23-10-2-1-3-11-23)29-28-24-12-5-4-9-22(24)21-33-26-14-7-6-13-25(26)28/h1-7,9-14,28H,8,15-21H2,(H,29,32)