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

Systemtic Name: 1-[4-(oxolan-2-ylmethyl)-1,4-diazepan-1-yl]-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)propan-1-one Openeye Name: 3-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]-1-[4-(tetrahydrofuran-2-ylmethyl)-1,4-diazepan-1-yl]propan-1-one CAS Name: 1-[4-(2-oxolanylmethyl)-1,4-diazepan-1-yl]-3-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]-1-propanone IUPAC Name: 1-[4-(oxolan-2-ylmethyl)-1,4-diazepan-1-yl]-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)propan-1-one Traditional Name: 3-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]-1-[4-(tetrahydrofurfuryl)-1,4-diazepan-1-yl]propan-1-one Formula: C20H27N5O3 MolecularWeight: 385.46008

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2CCCN(CC2)C(=O)CCC3=NC(=NO3)C4=CN=CC=C4

Isomeric SMILES

C1CC(OC1)CN2CCCN(CC2)C(=O)CCC3=NC(=NO3)C4=CN=CC=C4

InChI

InChI=1S/C20H27N5O3/c26-19(7-6-18-22-20(23-28-18)16-4-1-8-21-14-16)25-10-3-9-24(11-12-25)15-17-5-2-13-27-17/h1,4,8,14,17H,2-3,5-7,9-13,15H2