N-[3-[[(3-azanyl-2,2-dimethyl-propyl)-cyclohexylcarbonyl-amino]methyl]phenyl]-4-cyano-benzamide

Systemtic Name: N-[3-[[(3-azanyl-2,2-dimethyl-propyl)-cyclohexylcarbonyl-amino]methyl]phenyl]-4-cyano-benzamide Openeye Name: N-[3-[[(3-amino-2,2-dimethyl-propyl)-(cyclohexanecarbonyl)amino]methyl]phenyl]-4-cyano-benzamide CAS Name: N-[3-[[(3-amino-2,2-dimethylpropyl)-[cyclohexyl(oxo)methyl]amino]methyl]phenyl]-4-cyanobenzamide IUPAC Name: N-[3-[[(3-amino-2,2-dimethylpropyl)-(cyclohexanecarbonyl)amino]methyl]phenyl]-4-cyanobenzamide Traditional Name: N-[3-[[(3-amino-2,2-dimethyl-propyl)-(cyclohexanecarbonyl)amino]methyl]phenyl]-4-cyano-benzamide Formula: C27H34N4O2 MolecularWeight: 446.58446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN)CN(CC1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)C#N)C(=O)C3CCCCC3

Isomeric SMILES

CC(C)(CN)CN(CC1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)C#N)C(=O)C3CCCCC3

InChI

InChI=1S/C27H34N4O2/c1-27(2,18-29)19-31(26(33)23-8-4-3-5-9-23)17-21-7-6-10-24(15-21)30-25(32)22-13-11-20(16-28)12-14-22/h6-7,10-15,23H,3-5,8-9,17-19,29H2,1-2H3,(H,30,32)