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

Systemtic Name: 4-tert-butyl-N-[6-[4-(3-methyl-2-oxidanyl-butyl)-1,4-diazepan-1-yl]pyridin-3-yl]benzamide Openeye Name: 4-tert-butyl-N-[6-[4-(2-hydroxy-3-methyl-butyl)-1,4-diazepan-1-yl]-3-pyridyl]benzamide CAS Name: 4-tert-butyl-N-[6-[4-(2-hydroxy-3-methylbutyl)-1,4-diazepan-1-yl]-3-pyridinyl]benzamide IUPAC Name: 4-tert-butyl-N-[6-[4-(2-hydroxy-3-methylbutyl)-1,4-diazepan-1-yl]pyridin-3-yl]benzamide Traditional Name: 4-tert-butyl-N-[6-[4-(2-hydroxy-3-methyl-butyl)-1,4-diazepan-1-yl]-3-pyridyl]benzamide Formula: C26H38N4O2 MolecularWeight: 438.60552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CN1CCCN(CC1)C2=NC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)O

Isomeric SMILES

CC(C)C(CN1CCCN(CC1)C2=NC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)O

InChI

InChI=1S/C26H38N4O2/c1-19(2)23(31)18-29-13-6-14-30(16-15-29)24-12-11-22(17-27-24)28-25(32)20-7-9-21(10-8-20)26(3,4)5/h7-12,17,19,23,31H,6,13-16,18H2,1-5H3,(H,28,32)