3,5-dimethoxy-1-pyridin-2-yl-2-(4-pyrrolidin-1-ylphenyl)-1,4-diazepane

Systemtic Name: 3,5-dimethoxy-1-pyridin-2-yl-2-(4-pyrrolidin-1-ylphenyl)-1,4-diazepane Openeye Name: 3,5-dimethoxy-1-(2-pyridyl)-2-(4-pyrrolidin-1-ylphenyl)-1,4-diazepane CAS Name: 3,5-dimethoxy-1-(2-pyridinyl)-2-[4-(1-pyrrolidinyl)phenyl]-1,4-diazepane IUPAC Name: 3,5-dimethoxy-1-pyridin-2-yl-2-(4-pyrrolidin-1-ylphenyl)-1,4-diazepane Traditional Name: 3,5-dimethoxy-1-(2-pyridyl)-2-(4-pyrrolidinophenyl)-1,4-diazepane Formula: C22H30N4O2 MolecularWeight: 382.4992

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCN(C(C(N1)OC)C2=CC=C(C=C2)N3CCCC3)C4=CC=CC=N4

Isomeric SMILES

COC1CCN(C(C(N1)OC)C2=CC=C(C=C2)N3CCCC3)C4=CC=CC=N4

InChI

InChI=1S/C22H30N4O2/c1-27-20-12-16-26(19-7-3-4-13-23-19)21(22(24-20)28-2)17-8-10-18(11-9-17)25-14-5-6-15-25/h3-4,7-11,13,20-22,24H,5-6,12,14-16H2,1-2H3