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

Systemtic Name: 4-tert-butyl-N-[6-[4-(2-oxidanylpropyl)-1,4-diazepan-1-yl]pyridin-3-yl]benzamide Openeye Name: 4-tert-butyl-N-[6-[4-(2-hydroxypropyl)-1,4-diazepan-1-yl]-3-pyridyl]benzamide CAS Name: 4-tert-butyl-N-[6-[4-(2-hydroxypropyl)-1,4-diazepan-1-yl]-3-pyridinyl]benzamide IUPAC Name: 4-tert-butyl-N-[6-[4-(2-hydroxypropyl)-1,4-diazepan-1-yl]pyridin-3-yl]benzamide Traditional Name: 4-tert-butyl-N-[6-[4-(2-hydroxypropyl)-1,4-diazepan-1-yl]-3-pyridyl]benzamide Formula: C24H34N4O2 MolecularWeight: 410.55236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H34N4O2/c1-18(29)17-27-12-5-13-28(15-14-27)22-11-10-21(16-25-22)26-23(30)19-6-8-20(9-7-19)24(2,3)4/h6-11,16,18,29H,5,12-15,17H2,1-4H3,(H,26,30)