3-(azepan-1-ylsulfonyl)-N-[2-(4-phenylpiperazin-1-yl)ethyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-[2-(4-phenylpiperazin-1-yl)ethyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-[2-(4-phenylpiperazin-1-yl)ethyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-[2-(4-phenyl-1-piperazinyl)ethyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-[2-(4-phenylpiperazin-1-yl)ethyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-[2-(4-phenylpiperazino)ethyl]benzamide Formula: C25H34N4O3S MolecularWeight: 470.62746

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCCN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCCN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H34N4O3S/c30-25(26-13-16-27-17-19-28(20-18-27)23-10-4-3-5-11-23)22-9-8-12-24(21-22)33(31,32)29-14-6-1-2-7-15-29/h3-5,8-12,21H,1-2,6-7,13-20H2,(H,26,30)