1-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propan-1-one

Systemtic Name: 1-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propan-1-one Openeye Name: 1-[4-(o-tolylmethyl)piperazin-1-yl]-3-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]propan-1-one CAS Name: 1-[4-[(2-methylphenyl)methyl]-1-piperazinyl]-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)-1-propanone IUPAC Name: 1-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propan-1-one Traditional Name: 1-[4-(2-methylbenzyl)piperazino]-3-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]propan-1-one Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=O)CCC3=NC(=NO3)C4=CC=NC=C4

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=O)CCC3=NC(=NO3)C4=CC=NC=C4

InChI

InChI=1S/C22H25N5O2/c1-17-4-2-3-5-19(17)16-26-12-14-27(15-13-26)21(28)7-6-20-24-22(25-29-20)18-8-10-23-11-9-18/h2-5,8-11H,6-7,12-16H2,1H3