4-tert-butyl-N-[6-[4-(3-morpholin-4-yl-2-oxidanyl-propyl)-1,4-diazepan-1-yl]pyridin-3-yl]benzamide

Systemtic Name: 4-tert-butyl-N-[6-[4-(3-morpholin-4-yl-2-oxidanyl-propyl)-1,4-diazepan-1-yl]pyridin-3-yl]benzamide Openeye Name: 4-tert-butyl-N-[6-[4-(2-hydroxy-3-morpholino-propyl)-1,4-diazepan-1-yl]-3-pyridyl]benzamide CAS Name: 4-tert-butyl-N-[6-[4-[2-hydroxy-3-(4-morpholinyl)propyl]-1,4-diazepan-1-yl]-3-pyridinyl]benzamide IUPAC Name: 4-tert-butyl-N-[6-[4-(2-hydroxy-3-morpholin-4-ylpropyl)-1,4-diazepan-1-yl]pyridin-3-yl]benzamide Traditional Name: 4-tert-butyl-N-[6-[4-(2-hydroxy-3-morpholino-propyl)-1,4-diazepan-1-yl]-3-pyridyl]benzamide Formula: C28H41N5O3 MolecularWeight: 495.65684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CN=C(C=C2)N3CCCN(CC3)CC(CN4CCOCC4)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CN=C(C=C2)N3CCCN(CC3)CC(CN4CCOCC4)O

InChI

InChI=1S/C28H41N5O3/c1-28(2,3)23-7-5-22(6-8-23)27(35)30-24-9-10-26(29-19-24)33-12-4-11-31(13-14-33)20-25(34)21-32-15-17-36-18-16-32/h5-10,19,25,34H,4,11-18,20-21H2,1-3H3,(H,30,35)