N-[6-[4-(2-oxidanyl-2-phenyl-ethyl)-1,4-diazepan-1-yl]pyridin-3-yl]furan-2-carboxamide

Systemtic Name: N-[6-[4-(2-oxidanyl-2-phenyl-ethyl)-1,4-diazepan-1-yl]pyridin-3-yl]furan-2-carboxamide Openeye Name: N-[6-[4-(2-hydroxy-2-phenyl-ethyl)-1,4-diazepan-1-yl]-3-pyridyl]furan-2-carboxamide CAS Name: N-[6-[4-(2-hydroxy-2-phenylethyl)-1,4-diazepan-1-yl]-3-pyridinyl]-2-furancarboxamide IUPAC Name: N-[6-[4-(2-hydroxy-2-phenylethyl)-1,4-diazepan-1-yl]pyridin-3-yl]furan-2-carboxamide Traditional Name: N-[6-[4-(2-hydroxy-2-phenyl-ethyl)-1,4-diazepan-1-yl]-3-pyridyl]-2-furamide Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C2=NC=C(C=C2)NC(=O)C3=CC=CO3)CC(C4=CC=CC=C4)O

Isomeric SMILES

C1CN(CCN(C1)C2=NC=C(C=C2)NC(=O)C3=CC=CO3)CC(C4=CC=CC=C4)O

InChI

InChI=1S/C23H26N4O3/c28-20(18-6-2-1-3-7-18)17-26-11-5-12-27(14-13-26)22-10-9-19(16-24-22)25-23(29)21-8-4-15-30-21/h1-4,6-10,15-16,20,28H,5,11-14,17H2,(H,25,29)