N-(3-azanyl-2,2-dimethyl-propyl)-N-[[2-chloranyl-5-(cyclobutylcarbonylamino)phenyl]methyl]-4-cyano-benzamide

Systemtic Name: N-(3-azanyl-2,2-dimethyl-propyl)-N-[[2-chloranyl-5-(cyclobutylcarbonylamino)phenyl]methyl]-4-cyano-benzamide Openeye Name: N-(3-amino-2,2-dimethyl-propyl)-N-[[2-chloro-5-(cyclobutanecarbonylamino)phenyl]methyl]-4-cyano-benzamide CAS Name: N-(3-amino-2,2-dimethylpropyl)-N-[[2-chloro-5-[[cyclobutyl(oxo)methyl]amino]phenyl]methyl]-4-cyanobenzamide IUPAC Name: N-(3-amino-2,2-dimethylpropyl)-N-[[2-chloro-5-(cyclobutanecarbonylamino)phenyl]methyl]-4-cyanobenzamide Traditional Name: N-(3-amino-2,2-dimethyl-propyl)-N-[2-chloro-5-(cyclobutanecarbonylamino)benzyl]-4-cyano-benzamide Formula: C25H29ClN4O2 MolecularWeight: 452.97636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN)CN(CC1=C(C=CC(=C1)NC(=O)C2CCC2)Cl)C(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(C)(CN)CN(CC1=C(C=CC(=C1)NC(=O)C2CCC2)Cl)C(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C25H29ClN4O2/c1-25(2,15-28)16-30(24(32)19-8-6-17(13-27)7-9-19)14-20-12-21(10-11-22(20)26)29-23(31)18-4-3-5-18/h6-12,18H,3-5,14-16,28H2,1-2H3,(H,29,31)