4-[4-(imidazol-1-ylmethyl)phenyl]sulfonyl-1-[(1-pyridin-4-ylpiperidin-4-yl)methyl]piperazin-2-one

Systemtic Name: 4-[4-(imidazol-1-ylmethyl)phenyl]sulfonyl-1-[(1-pyridin-4-ylpiperidin-4-yl)methyl]piperazin-2-one Openeye Name: 4-[4-(imidazol-1-ylmethyl)phenyl]sulfonyl-1-[[1-(4-pyridyl)-4-piperidyl]methyl]piperazin-2-one CAS Name: 4-[4-(1-imidazolylmethyl)phenyl]sulfonyl-1-[(1-pyridin-4-yl-4-piperidinyl)methyl]-2-piperazinone IUPAC Name: 4-[4-(imidazol-1-ylmethyl)phenyl]sulfonyl-1-[(1-pyridin-4-ylpiperidin-4-yl)methyl]piperazin-2-one Traditional Name: 4-[4-(imidazol-1-ylmethyl)phenyl]sulfonyl-1-[[1-(4-pyridyl)-4-piperidyl]methyl]piperazin-2-one Formula: C25H30N6O3S MolecularWeight: 494.6091

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2CCN(CC2=O)S(=O)(=O)C3=CC=C(C=C3)CN4C=CN=C4)C5=CC=NC=C5

Isomeric SMILES

C1CN(CCC1CN2CCN(CC2=O)S(=O)(=O)C3=CC=C(C=C3)CN4C=CN=C4)C5=CC=NC=C5

InChI

InChI=1S/C25H30N6O3S/c32-25-19-31(35(33,34)24-3-1-21(2-4-24)17-28-14-11-27-20-28)16-15-30(25)18-22-7-12-29(13-8-22)23-5-9-26-10-6-23/h1-6,9-11,14,20,22H,7-8,12-13,15-19H2