1,4-bis[5-(2,3,5-trimethylphenyl)pyridin-2-yl]-1,4-diazepane

Systemtic Name: 1,4-bis[5-(2,3,5-trimethylphenyl)pyridin-2-yl]-1,4-diazepane Openeye Name: 1,4-bis[5-(2,3,5-trimethylphenyl)-2-pyridyl]-1,4-diazepane CAS Name: 1,4-bis[5-(2,3,5-trimethylphenyl)-2-pyridinyl]-1,4-diazepane IUPAC Name: 1,4-bis[5-(2,3,5-trimethylphenyl)pyridin-2-yl]-1,4-diazepane Traditional Name: 1,4-bis[5-(2,3,5-trimethylphenyl)-2-pyridyl]-1,4-diazepane Formula: C33H38N4 MolecularWeight: 490.68162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C2=CN=C(C=C2)N3CCCN(CC3)C4=NC=C(C=C4)C5=CC(=CC(=C5C)C)C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C2=CN=C(C=C2)N3CCCN(CC3)C4=NC=C(C=C4)C5=CC(=CC(=C5C)C)C)C)C

InChI

InChI=1S/C33H38N4/c1-22-16-24(3)26(5)30(18-22)28-8-10-32(34-20-28)36-12-7-13-37(15-14-36)33-11-9-29(21-35-33)31-19-23(2)17-25(4)27(31)6/h8-11,16-21H,7,12-15H2,1-6H3