2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[5-(1-azepanylsulfonyl)-1-indolyl]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-1-(4-phenylpiperazino)ethanone Formula: C26H32N4O3S MolecularWeight: 480.62228

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C=C3)CC(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C=C3)CC(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C26H32N4O3S/c31-26(28-18-16-27(17-19-28)23-8-4-3-5-9-23)21-29-15-12-22-20-24(10-11-25(22)29)34(32,33)30-13-6-1-2-7-14-30/h3-5,8-12,15,20H,1-2,6-7,13-14,16-19,21H2