4-tert-butyl-N-[4-[1-(1,4-diazepan-1-yl)-1-oxidanylidene-propan-2-yl]phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[4-[1-(1,4-diazepan-1-yl)-1-oxidanylidene-propan-2-yl]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[4-[2-(1,4-diazepan-1-yl)-1-methyl-2-oxo-ethyl]phenyl]benzamide CAS Name: 4-tert-butyl-N-[4-[1-(1,4-diazepan-1-yl)-1-oxopropan-2-yl]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[4-[1-(1,4-diazepan-1-yl)-1-oxopropan-2-yl]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[4-[2-(1,4-diazepan-1-yl)-2-keto-1-methyl-ethyl]phenyl]benzamide Formula: C25H33N3O2 MolecularWeight: 407.54842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C(C)(C)C)C(=O)N3CCCNCC3

Isomeric SMILES

CC(C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C(C)(C)C)C(=O)N3CCCNCC3

InChI

InChI=1S/C25H33N3O2/c1-18(24(30)28-16-5-14-26-15-17-28)19-8-12-22(13-9-19)27-23(29)20-6-10-21(11-7-20)25(2,3)4/h6-13,18,26H,5,14-17H2,1-4H3,(H,27,29)