N-[6-[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]pyridin-3-yl]cyclopentanecarboxamide

Systemtic Name: N-[6-[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]pyridin-3-yl]cyclopentanecarboxamide Openeye Name: N-[6-[4-(3-pyridylmethyl)-1,4-diazepan-1-yl]-3-pyridyl]cyclopentanecarboxamide CAS Name: N-[6-[4-(3-pyridinylmethyl)-1,4-diazepan-1-yl]-3-pyridinyl]cyclopentanecarboxamide IUPAC Name: N-[6-[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]pyridin-3-yl]cyclopentanecarboxamide Traditional Name: N-[6-[4-(3-pyridylmethyl)-1,4-diazepan-1-yl]-3-pyridyl]cyclopentanecarboxamide Formula: C22H29N5O MolecularWeight: 379.49856

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)NC2=CN=C(C=C2)N3CCCN(CC3)CC4=CN=CC=C4

Isomeric SMILES

C1CCC(C1)C(=O)NC2=CN=C(C=C2)N3CCCN(CC3)CC4=CN=CC=C4

InChI

InChI=1S/C22H29N5O/c28-22(19-6-1-2-7-19)25-20-8-9-21(24-16-20)27-12-4-11-26(13-14-27)17-18-5-3-10-23-15-18/h3,5,8-10,15-16,19H,1-2,4,6-7,11-14,17H2,(H,25,28)