3-[[4-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-1,4-diazepan-1-yl]methyl]-5-phenyl-1,2,4-oxadiazole

Systemtic Name: 3-[[4-[(3-cyclopentyloxy-4-methoxy-phenyl)methyl]-1,4-diazepan-1-yl]methyl]-5-phenyl-1,2,4-oxadiazole Openeye Name: 3-[[4-[[3-(cyclopentoxy)-4-methoxy-phenyl]methyl]-1,4-diazepan-1-yl]methyl]-5-phenyl-1,2,4-oxadiazole CAS Name: 3-[[4-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]methyl]-5-phenyl-1,2,4-oxadiazole IUPAC Name: 3-[[4-[(3-cyclopentyloxy-4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]methyl]-5-phenyl-1,2,4-oxadiazole Traditional Name: 3-[[4-[3-(cyclopentoxy)-4-methoxy-benzyl]-1,4-diazepan-1-yl]methyl]-5-phenyl-1,2,4-oxadiazole Formula: C27H34N4O3 MolecularWeight: 462.58386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCCN(CC2)CC3=NOC(=N3)C4=CC=CC=C4)OC5CCCC5

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCCN(CC2)CC3=NOC(=N3)C4=CC=CC=C4)OC5CCCC5

InChI

InChI=1S/C27H34N4O3/c1-32-24-13-12-21(18-25(24)33-23-10-5-6-11-23)19-30-14-7-15-31(17-16-30)20-26-28-27(34-29-26)22-8-3-2-4-9-22/h2-4,8-9,12-13,18,23H,5-7,10-11,14-17,19-20H2,1H3