4-(6-bromanylnaphthalen-2-yl)sulfonyl-1-[ethyl-(1-pyridin-4-ylpiperidin-4-yl)amino]piperazin-2-one

Systemtic Name: 4-(6-bromanylnaphthalen-2-yl)sulfonyl-1-[ethyl-(1-pyridin-4-ylpiperidin-4-yl)amino]piperazin-2-one Openeye Name: 4-[(6-bromo-2-naphthyl)sulfonyl]-1-[ethyl-[1-(4-pyridyl)-4-piperidyl]amino]piperazin-2-one CAS Name: 4-[(6-bromo-2-naphthalenyl)sulfonyl]-1-[ethyl-(1-pyridin-4-yl-4-piperidinyl)amino]-2-piperazinone IUPAC Name: 4-(6-bromonaphthalen-2-yl)sulfonyl-1-[ethyl-(1-pyridin-4-ylpiperidin-4-yl)amino]piperazin-2-one Traditional Name: 4-[(6-bromo-2-naphthyl)sulfonyl]-1-[ethyl-[1-(4-pyridyl)-4-piperidyl]amino]piperazin-2-one Formula: C26H30BrN5O3S MolecularWeight: 572.5171

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCN(CC1)C2=CC=NC=C2)N3CCN(CC3=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Br

Isomeric SMILES

CCN(C1CCN(CC1)C2=CC=NC=C2)N3CCN(CC3=O)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Br

InChI

InChI=1S/C26H30BrN5O3S/c1-2-31(24-9-13-29(14-10-24)23-7-11-28-12-8-23)32-16-15-30(19-26(32)33)36(34,35)25-6-4-20-17-22(27)5-3-21(20)18-25/h3-8,11-12,17-18,24H,2,9-10,13-16,19H2,1H3