5-bromanyl-N-[2-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[2-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[2-[4-(o-tolylmethyl)-1,4-diazepan-1-yl]-2-oxo-ethyl]furan-2-carboxamide CAS Name: 5-bromo-N-[2-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[2-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[2-keto-2-[4-(2-methylbenzyl)-1,4-diazepan-1-yl]ethyl]-2-furamide Formula: C20H24BrN3O3 MolecularWeight: 434.32686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCCN(CC2)C(=O)CNC(=O)C3=CC=C(O3)Br

Isomeric SMILES

CC1=CC=CC=C1CN2CCCN(CC2)C(=O)CNC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C20H24BrN3O3/c1-15-5-2-3-6-16(15)14-23-9-4-10-24(12-11-23)19(25)13-22-20(26)17-7-8-18(21)27-17/h2-3,5-8H,4,9-14H2,1H3,(H,22,26)