4-[(4-methoxy-3-methyl-phenyl)methyl]-3-[2-oxidanylidene-2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]ethyl]piperazin-2-one

Systemtic Name: 4-[(4-methoxy-3-methyl-phenyl)methyl]-3-[2-oxidanylidene-2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]ethyl]piperazin-2-one Openeye Name: 4-[(4-methoxy-3-methyl-phenyl)methyl]-3-[2-oxo-2-[4-(2-pyridylmethyl)piperazin-1-yl]ethyl]piperazin-2-one CAS Name: 4-[(4-methoxy-3-methylphenyl)methyl]-3-[2-oxo-2-[4-(2-pyridinylmethyl)-1-piperazinyl]ethyl]-2-piperazinone IUPAC Name: 4-[(4-methoxy-3-methylphenyl)methyl]-3-[2-oxo-2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]ethyl]piperazin-2-one Traditional Name: 3-[2-keto-2-[4-(2-pyridylmethyl)piperazino]ethyl]-4-(4-methoxy-3-methyl-benzyl)piperazin-2-one Formula: C25H33N5O3 MolecularWeight: 451.56122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CN2CCNC(=O)C2CC(=O)N3CCN(CC3)CC4=CC=CC=N4)OC

Isomeric SMILES

CC1=C(C=CC(=C1)CN2CCNC(=O)C2CC(=O)N3CCN(CC3)CC4=CC=CC=N4)OC

InChI

InChI=1S/C25H33N5O3/c1-19-15-20(6-7-23(19)33-2)17-30-10-9-27-25(32)22(30)16-24(31)29-13-11-28(12-14-29)18-21-5-3-4-8-26-21/h3-8,15,22H,9-14,16-18H2,1-2H3,(H,27,32)