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

Systemtic Name: N-(cyanomethyl)-3-cyclohexyl-2-[(2-oxidanylidene-1,3-benzoxazin-4-yl)amino]propanamide Openeye Name: N-(cyanomethyl)-3-cyclohexyl-2-[(2-oxo-1,3-benzoxazin-4-yl)amino]propanamide CAS Name: N-(cyanomethyl)-3-cyclohexyl-2-[(2-oxo-1,3-benzoxazin-4-yl)amino]propanamide IUPAC Name: N-(cyanomethyl)-3-cyclohexyl-2-[(2-oxo-1,3-benzoxazin-4-yl)amino]propanamide Traditional Name: N-(cyanomethyl)-3-cyclohexyl-2-[(2-keto-1,3-benzoxazin-4-yl)amino]propionamide Formula: C19H22N4O3 MolecularWeight: 354.40298

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)NCC#N)NC2=NC(=O)OC3=CC=CC=C32

Isomeric SMILES

C1CCC(CC1)CC(C(=O)NCC#N)NC2=NC(=O)OC3=CC=CC=C32

InChI

InChI=1S/C19H22N4O3/c20-10-11-21-18(24)15(12-13-6-2-1-3-7-13)22-17-14-8-4-5-9-16(14)26-19(25)23-17/h4-5,8-9,13,15H,1-3,6-7,11-12H2,(H,21,24)(H,22,23,25)