N-(1-cyanocyclopropyl)-3-cyclohexyl-2-[(2-oxidanylidene-1,3-benzoxazin-4-yl)amino]propanamide

Systemtic Name: N-(1-cyanocyclopropyl)-3-cyclohexyl-2-[(2-oxidanylidene-1,3-benzoxazin-4-yl)amino]propanamide Openeye Name: N-(1-cyanocyclopropyl)-3-cyclohexyl-2-[(2-oxo-1,3-benzoxazin-4-yl)amino]propanamide CAS Name: N-(1-cyanocyclopropyl)-3-cyclohexyl-2-[(2-oxo-1,3-benzoxazin-4-yl)amino]propanamide IUPAC Name: N-(1-cyanocyclopropyl)-3-cyclohexyl-2-[(2-oxo-1,3-benzoxazin-4-yl)amino]propanamide Traditional Name: N-(1-cyanocyclopropyl)-3-cyclohexyl-2-[(2-keto-1,3-benzoxazin-4-yl)amino]propionamide Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)NC2(CC2)C#N)NC3=NC(=O)OC4=CC=CC=C43

Isomeric SMILES

C1CCC(CC1)CC(C(=O)NC2(CC2)C#N)NC3=NC(=O)OC4=CC=CC=C43

InChI

InChI=1S/C21H24N4O3/c22-13-21(10-11-21)25-19(26)16(12-14-6-2-1-3-7-14)23-18-15-8-4-5-9-17(15)28-20(27)24-18/h4-5,8-9,14,16H,1-3,6-7,10-12H2,(H,25,26)(H,23,24,27)