4-tert-butyl-N-[4-[5-(1,4-diazepan-1-ylcarbonyl)furan-2-yl]phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[4-[5-(1,4-diazepan-1-ylcarbonyl)furan-2-yl]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[4-[5-(1,4-diazepane-1-carbonyl)-2-furyl]phenyl]benzamide CAS Name: 4-tert-butyl-N-[4-[5-[1,4-diazepan-1-yl(oxo)methyl]-2-furanyl]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[4-[5-(1,4-diazepane-1-carbonyl)furan-2-yl]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[4-[5-(1,4-diazepane-1-carbonyl)-2-furyl]phenyl]benzamide Formula: C27H31N3O3 MolecularWeight: 445.55334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C3=CC=C(O3)C(=O)N4CCCNCC4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C3=CC=C(O3)C(=O)N4CCCNCC4

InChI

InChI=1S/C27H31N3O3/c1-27(2,3)21-9-5-20(6-10-21)25(31)29-22-11-7-19(8-12-22)23-13-14-24(33-23)26(32)30-17-4-15-28-16-18-30/h5-14,28H,4,15-18H2,1-3H3,(H,29,31)