1-[5-[3-(3-phenylpropyl)-1,2,4-oxadiazol-5-yl]pyridin-2-yl]-1,4-diazepan-5-one

Systemtic Name: 1-[5-[3-(3-phenylpropyl)-1,2,4-oxadiazol-5-yl]pyridin-2-yl]-1,4-diazepan-5-one Openeye Name: 1-[5-[3-(3-phenylpropyl)-1,2,4-oxadiazol-5-yl]-2-pyridyl]-1,4-diazepan-5-one CAS Name: 1-[5-[3-(3-phenylpropyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]-1,4-diazepan-5-one IUPAC Name: 1-[5-[3-(3-phenylpropyl)-1,2,4-oxadiazol-5-yl]pyridin-2-yl]-1,4-diazepan-5-one Traditional Name: 1-[5-[3-(3-phenylpropyl)-1,2,4-oxadiazol-5-yl]-2-pyridyl]-1,4-diazepan-5-one Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCNC1=O)C2=NC=C(C=C2)C3=NC(=NO3)CCCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCNC1=O)C2=NC=C(C=C2)C3=NC(=NO3)CCCC4=CC=CC=C4

InChI

InChI=1S/C21H23N5O2/c27-20-11-13-26(14-12-22-20)19-10-9-17(15-23-19)21-24-18(25-28-21)8-4-7-16-5-2-1-3-6-16/h1-3,5-6,9-10,15H,4,7-8,11-14H2,(H,22,27)