[4-[4-(4-bromophenyl)phenyl]sulfonylpiperazin-1-yl]-(1-pyridin-4-ylpiperidin-4-yl)methanone

Systemtic Name: [4-[4-(4-bromophenyl)phenyl]sulfonylpiperazin-1-yl]-(1-pyridin-4-ylpiperidin-4-yl)methanone Openeye Name: [4-[4-(4-bromophenyl)phenyl]sulfonylpiperazin-1-yl]-[1-(4-pyridyl)-4-piperidyl]methanone CAS Name: [4-[4-(4-bromophenyl)phenyl]sulfonyl-1-piperazinyl]-(1-pyridin-4-yl-4-piperidinyl)methanone IUPAC Name: [4-[4-(4-bromophenyl)phenyl]sulfonylpiperazin-1-yl]-(1-pyridin-4-ylpiperidin-4-yl)methanone Traditional Name: [4-[4-(4-bromophenyl)phenyl]sulfonylpiperazino]-[1-(4-pyridyl)-4-piperidyl]methanone Formula: C27H29BrN4O3S MolecularWeight: 569.51316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)Br)C5=CC=NC=C5

Isomeric SMILES

C1CN(CCC1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)Br)C5=CC=NC=C5

InChI

InChI=1S/C27H29BrN4O3S/c28-24-5-1-21(2-6-24)22-3-7-26(8-4-22)36(34,35)32-19-17-31(18-20-32)27(33)23-11-15-30(16-12-23)25-9-13-29-14-10-25/h1-10,13-14,23H,11-12,15-20H2