4-(3,3-dimethylbutanoyl)-N-(4-propan-2-ylphenyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-(3,3-dimethylbutanoyl)-N-(4-propan-2-ylphenyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-(3,3-dimethylbutanoyl)-N-(4-isopropylphenyl)-1,4-diazepane-1-carboxamide CAS Name: 4-(3,3-dimethyl-1-oxobutyl)-N-(4-propan-2-ylphenyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-(3,3-dimethylbutanoyl)-N-(4-propan-2-ylphenyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-(3,3-dimethylbutanoyl)-N-p-cumenyl-1,4-diazepane-1-carboxamide Formula: C21H33N3O2 MolecularWeight: 359.50562

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)N2CCCN(CC2)C(=O)CC(C)(C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)N2CCCN(CC2)C(=O)CC(C)(C)C

InChI

InChI=1S/C21H33N3O2/c1-16(2)17-7-9-18(10-8-17)22-20(26)24-12-6-11-23(13-14-24)19(25)15-21(3,4)5/h7-10,16H,6,11-15H2,1-5H3,(H,22,26)