N-[3-[(3-carbamimidoylphenyl)methyl]-4-oxidanylidene-butan-2-yl]-4-phenyl-benzamide

Systemtic Name: N-[3-[(3-carbamimidoylphenyl)methyl]-4-oxidanylidene-butan-2-yl]-4-phenyl-benzamide Openeye Name: N-[2-[(3-carbamimidoylphenyl)methyl]-1-methyl-3-oxo-propyl]-4-phenyl-benzamide CAS Name: N-[3-[(3-carbamimidoylphenyl)methyl]-4-oxobutan-2-yl]-4-phenylbenzamide IUPAC Name: N-[3-[(3-carbamimidoylphenyl)methyl]-4-oxobutan-2-yl]-4-phenylbenzamide Traditional Name: N-[2-(3-amidinobenzyl)-3-keto-1-methyl-propyl]-4-phenyl-benzamide Formula: C25H25N3O2 MolecularWeight: 399.4849

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CC1=CC=CC(=C1)C(=N)N)C=O)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C(CC1=CC=CC(=C1)C(=N)N)C=O)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C25H25N3O2/c1-17(23(16-29)15-18-6-5-9-22(14-18)24(26)27)28-25(30)21-12-10-20(11-13-21)19-7-3-2-4-8-19/h2-14,16-17,23H,15H2,1H3,(H3,26,27)(H,28,30)