1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-[(phenylmethyl)-propan-2-yl-amino]ethanone

Systemtic Name: 1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-[(phenylmethyl)-propan-2-yl-amino]ethanone Openeye Name: 2-[benzyl(isopropyl)amino]-1-[4-(2-naphthylsulfonyl)piperazin-1-yl]ethanone CAS Name: 1-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-2-[(phenylmethyl)-propan-2-ylamino]ethanone IUPAC Name: 2-[benzyl(propan-2-yl)amino]-1-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-[benzyl(isopropyl)amino]-1-[4-(2-naphthylsulfonyl)piperazino]ethanone Formula: C26H31N3O3S MolecularWeight: 465.60764

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC=CC=C1)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C)N(CC1=CC=CC=C1)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C26H31N3O3S/c1-21(2)28(19-22-8-4-3-5-9-22)20-26(30)27-14-16-29(17-15-27)33(31,32)25-13-12-23-10-6-7-11-24(23)18-25/h3-13,18,21H,14-17,19-20H2,1-2H3