1-[[4-(6-bromanylnaphthalen-2-yl)sulfonyl-1-pyridin-4-yl-piperidin-4-yl]methyl]piperazine

Systemtic Name: 1-[[4-(6-bromanylnaphthalen-2-yl)sulfonyl-1-pyridin-4-yl-piperidin-4-yl]methyl]piperazine Openeye Name: 1-[[4-[(6-bromo-2-naphthyl)sulfonyl]-1-(4-pyridyl)-4-piperidyl]methyl]piperazine CAS Name: 1-[[4-[(6-bromo-2-naphthalenyl)sulfonyl]-1-pyridin-4-yl-4-piperidinyl]methyl]piperazine IUPAC Name: 1-[[4-(6-bromonaphthalen-2-yl)sulfonyl-1-pyridin-4-ylpiperidin-4-yl]methyl]piperazine Traditional Name: 1-[[4-[(6-bromo-2-naphthyl)sulfonyl]-1-(4-pyridyl)-4-piperidyl]methyl]piperazine Formula: C25H29BrN4O2S MolecularWeight: 529.49236

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CN2CCNCC2)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Br)C5=CC=NC=C5

Isomeric SMILES

C1CN(CCC1(CN2CCNCC2)S(=O)(=O)C3=CC4=C(C=C3)C=C(C=C4)Br)C5=CC=NC=C5

InChI

InChI=1S/C25H29BrN4O2S/c26-22-3-1-21-18-24(4-2-20(21)17-22)33(31,32)25(19-29-15-11-28-12-16-29)7-13-30(14-8-25)23-5-9-27-10-6-23/h1-6,9-10,17-18,28H,7-8,11-16,19H2