N-[3-azanyl-7-(3-methylphenyl)-2-oxidanylidene-5-phenyl-azepan-1-yl]-N-tert-butyl-ethanamide

Systemtic Name: N-[3-azanyl-7-(3-methylphenyl)-2-oxidanylidene-5-phenyl-azepan-1-yl]-N-tert-butyl-ethanamide Openeye Name: N-[3-amino-7-(m-tolyl)-2-oxo-5-phenyl-azepan-1-yl]-N-tert-butyl-acetamide CAS Name: N-[3-amino-7-(3-methylphenyl)-2-oxo-5-phenyl-1-azepanyl]-N-tert-butylacetamide IUPAC Name: N-[3-amino-7-(3-methylphenyl)-2-oxo-5-phenylazepan-1-yl]-N-tert-butylacetamide Traditional Name: N-[3-amino-2-keto-7-(m-tolyl)-5-phenyl-azepan-1-yl]-N-tert-butyl-acetamide Formula: C25H33N3O2 MolecularWeight: 407.54842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2CC(CC(C(=O)N2N(C(=O)C)C(C)(C)C)N)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC(=C1)C2CC(CC(C(=O)N2N(C(=O)C)C(C)(C)C)N)C3=CC=CC=C3

InChI

InChI=1S/C25H33N3O2/c1-17-10-9-13-20(14-17)23-16-21(19-11-7-6-8-12-19)15-22(26)24(30)27(23)28(18(2)29)25(3,4)5/h6-14,21-23H,15-16,26H2,1-5H3