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

Systemtic Name: 1-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)propan-1-one Openeye Name: 1-[4-(m-tolylmethyl)piperazin-1-yl]-3-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]propan-1-one CAS Name: 1-[4-[(3-methylphenyl)methyl]-1-piperazinyl]-3-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]-1-propanone IUPAC Name: 1-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)propan-1-one Traditional Name: 1-[4-(3-methylbenzyl)piperazino]-3-[3-(3-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=C1)CN2CCN(CC2)C(=O)CCC3=NC(=NO3)C4=CN=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)CCC3=NC(=NO3)C4=CN=CC=C4

InChI

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