N-[4-[1-[[4-(aminomethyl)phenyl]methylamino]-1-oxidanylidene-propan-2-yl]phenyl]-3-cyano-benzamide

Systemtic Name: N-[4-[1-[[4-(aminomethyl)phenyl]methylamino]-1-oxidanylidene-propan-2-yl]phenyl]-3-cyano-benzamide Openeye Name: N-[4-[2-[[4-(aminomethyl)phenyl]methylamino]-1-methyl-2-oxo-ethyl]phenyl]-3-cyano-benzamide CAS Name: N-[4-[1-[[4-(aminomethyl)phenyl]methylamino]-1-oxopropan-2-yl]phenyl]-3-cyanobenzamide IUPAC Name: N-[4-[1-[[4-(aminomethyl)phenyl]methylamino]-1-oxopropan-2-yl]phenyl]-3-cyanobenzamide Traditional Name: N-[4-[2-[[4-(aminomethyl)benzyl]amino]-2-keto-1-methyl-ethyl]phenyl]-3-cyano-benzamide Formula: C25H24N4O2 MolecularWeight: 412.48366

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)NC(=O)C2=CC=CC(=C2)C#N)C(=O)NCC3=CC=C(C=C3)CN

Isomeric SMILES

CC(C1=CC=C(C=C1)NC(=O)C2=CC=CC(=C2)C#N)C(=O)NCC3=CC=C(C=C3)CN

InChI

InChI=1S/C25H24N4O2/c1-17(24(30)28-16-19-7-5-18(14-26)6-8-19)21-9-11-23(12-10-21)29-25(31)22-4-2-3-20(13-22)15-27/h2-13,17H,14,16,26H2,1H3,(H,28,30)(H,29,31)