(4-methyl-1,4-diazepan-1-yl)-[6-(2-phenylpyrrolidin-1-yl)pyridin-3-yl]methanone

Systemtic Name: (4-methyl-1,4-diazepan-1-yl)-[6-(2-phenylpyrrolidin-1-yl)pyridin-3-yl]methanone Openeye Name: (4-methyl-1,4-diazepan-1-yl)-[6-(2-phenylpyrrolidin-1-yl)-3-pyridyl]methanone CAS Name: (4-methyl-1,4-diazepan-1-yl)-[6-(2-phenyl-1-pyrrolidinyl)-3-pyridinyl]methanone IUPAC Name: (4-methyl-1,4-diazepan-1-yl)-[6-(2-phenylpyrrolidin-1-yl)pyridin-3-yl]methanone Traditional Name: (4-methyl-1,4-diazepan-1-yl)-[6-(2-phenylpyrrolidino)-3-pyridyl]methanone Formula: C22H28N4O MolecularWeight: 364.48392

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN(CC1)C(=O)C2=CN=C(C=C2)N3CCCC3C4=CC=CC=C4

Isomeric SMILES

CN1CCCN(CC1)C(=O)C2=CN=C(C=C2)N3CCCC3C4=CC=CC=C4

InChI

InChI=1S/C22H28N4O/c1-24-12-6-13-25(16-15-24)22(27)19-10-11-21(23-17-19)26-14-5-9-20(26)18-7-3-2-4-8-18/h2-4,7-8,10-11,17,20H,5-6,9,12-16H2,1H3