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

Systemtic Name: N-(3-azanyl-2,2-dimethyl-propyl)-4-cyano-N-[[3-(cyclohexylcarbonylamino)phenyl]methyl]benzamide Openeye Name: N-(3-amino-2,2-dimethyl-propyl)-4-cyano-N-[[3-(cyclohexanecarbonylamino)phenyl]methyl]benzamide CAS Name: N-(3-amino-2,2-dimethylpropyl)-4-cyano-N-[[3-[[cyclohexyl(oxo)methyl]amino]phenyl]methyl]benzamide IUPAC Name: N-(3-amino-2,2-dimethylpropyl)-4-cyano-N-[[3-(cyclohexanecarbonylamino)phenyl]methyl]benzamide Traditional Name: N-(3-amino-2,2-dimethyl-propyl)-4-cyano-N-[3-(cyclohexanecarbonylamino)benzyl]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)C2CCCCC2)C(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)(CN)CN(CC1=CC(=CC=C1)NC(=O)C2CCCCC2)C(=O)C3=CC=C(C=C3)C#N

InChI

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