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

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-[2-(4-phenylpiperazin-1-yl)ethyl]benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-[2-(4-phenylpiperazin-1-yl)ethyl]benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-[2-(4-phenyl-1-piperazinyl)ethyl]benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-[2-(4-phenylpiperazin-1-yl)ethyl]benzamide Traditional Name: 4-(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=C(C=C2)C(=O)NCCN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

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

InChI

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