N-tert-butyl-2-[4-(3-cyanophenyl)carbonyl-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-(3-cyanophenyl)carbonyl-1,4-diazepan-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-(3-cyanobenzoyl)-1,4-diazepan-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[(3-cyanophenyl)-oxomethyl]-1,4-diazepan-1-yl]acetamide IUPAC Name: N-tert-butyl-2-[4-(3-cyanobenzoyl)-1,4-diazepan-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-(3-cyanobenzoyl)-1,4-diazepan-1-yl]acetamide Formula: C19H26N4O2 MolecularWeight: 342.43534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN1CCCN(CC1)C(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

CC(C)(C)NC(=O)CN1CCCN(CC1)C(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C19H26N4O2/c1-19(2,3)21-17(24)14-22-8-5-9-23(11-10-22)18(25)16-7-4-6-15(12-16)13-20/h4,6-7,12H,5,8-11,14H2,1-3H3,(H,21,24)