N-[(3-carbamimidoylphenyl)methyl]-2-(3-ethyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl)ethanamide

Systemtic Name: N-[(3-carbamimidoylphenyl)methyl]-2-(3-ethyl-2-oxidanylidene-4,5-dihydro-3H-1-benzazepin-1-yl)ethanamide Openeye Name: N-[(3-carbamimidoylphenyl)methyl]-2-(3-ethyl-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)acetamide CAS Name: N-[(3-carbamimidoylphenyl)methyl]-2-(3-ethyl-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)acetamide IUPAC Name: N-[(3-carbamimidoylphenyl)methyl]-2-(3-ethyl-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)acetamide Traditional Name: N-(3-amidinobenzyl)-2-(3-ethyl-2-keto-4,5-dihydro-3H-1-benzazepin-1-yl)acetamide Formula: C22H26N4O2 MolecularWeight: 378.46744

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=CC=CC=C2N(C1=O)CC(=O)NCC3=CC=CC(=C3)C(=N)N

Isomeric SMILES

CCC1CCC2=CC=CC=C2N(C1=O)CC(=O)NCC3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C22H26N4O2/c1-2-16-10-11-17-7-3-4-9-19(17)26(22(16)28)14-20(27)25-13-15-6-5-8-18(12-15)21(23)24/h3-9,12,16H,2,10-11,13-14H2,1H3,(H3,23,24)(H,25,27)