4-[3-[1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]phenyl]-N-(2-dimethylaminoethyl)benzamide

Systemtic Name: 4-[3-[1-(cyanomethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]phenyl]-N-(2-dimethylaminoethyl)benzamide Openeye Name: 4-[3-[1-(cyanomethylcarbamoyl)-3-methyl-butyl]phenyl]-N-(2-dimethylaminoethyl)benzamide CAS Name: 4-[3-[1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]phenyl]-N-(2-dimethylaminoethyl)benzamide IUPAC Name: 4-[3-[1-(cyanomethylamino)-4-methyl-1-oxopentan-2-yl]phenyl]-N-(2-dimethylaminoethyl)benzamide Traditional Name: 4-[3-[1-(cyanomethylcarbamoyl)-3-methyl-butyl]phenyl]-N-(2-dimethylaminoethyl)benzamide Formula: C25H32N4O2 MolecularWeight: 420.54718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC(=C1)C2=CC=C(C=C2)C(=O)NCCN(C)C)C(=O)NCC#N

Isomeric SMILES

CC(C)CC(C1=CC=CC(=C1)C2=CC=C(C=C2)C(=O)NCCN(C)C)C(=O)NCC#N

InChI

InChI=1S/C25H32N4O2/c1-18(2)16-23(25(31)27-13-12-26)22-7-5-6-21(17-22)19-8-10-20(11-9-19)24(30)28-14-15-29(3)4/h5-11,17-18,23H,13-16H2,1-4H3,(H,27,31)(H,28,30)