2-(3-azanyl-1-cyclohexyl-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepin-5-yl)-N-tert-butyl-ethanamide

Systemtic Name: 2-(3-azanyl-1-cyclohexyl-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepin-5-yl)-N-tert-butyl-ethanamide Openeye Name: 2-(3-amino-1-cyclohexyl-4-oxo-2,3-dihydro-1,5-benzodiazepin-5-yl)-N-tert-butyl-acetamide CAS Name: 2-(3-amino-1-cyclohexyl-4-oxo-2,3-dihydro-1,5-benzodiazepin-5-yl)-N-tert-butylacetamide IUPAC Name: 2-(3-amino-1-cyclohexyl-4-oxo-2,3-dihydro-1,5-benzodiazepin-5-yl)-N-tert-butylacetamide Traditional Name: 2-(3-amino-1-cyclohexyl-4-keto-2,3-dihydro-1,5-benzodiazepin-5-yl)-N-tert-butyl-acetamide Formula: C21H32N4O2 MolecularWeight: 372.50438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN1C2=CC=CC=C2N(CC(C1=O)N)C3CCCCC3

Isomeric SMILES

CC(C)(C)NC(=O)CN1C2=CC=CC=C2N(CC(C1=O)N)C3CCCCC3

InChI

InChI=1S/C21H32N4O2/c1-21(2,3)23-19(26)14-25-18-12-8-7-11-17(18)24(13-16(22)20(25)27)15-9-5-4-6-10-15/h7-8,11-12,15-16H,4-6,9-10,13-14,22H2,1-3H3,(H,23,26)