N-[2-[[3-(2-methylpropanoylamino)phenyl]amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-[[3-(2-methylpropanoylamino)phenyl]amino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[3-(2-methylpropanoylamino)anilino]-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-[2-[3-[(2-methyl-1-oxopropyl)amino]anilino]-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[3-(2-methylpropanoylamino)anilino]-2-oxoethyl]adamantane-1-carboxamide Traditional Name: N-[2-[3-(isobutyrylamino)anilino]-2-keto-ethyl]adamantane-1-carboxamide Formula: C23H31N3O3 MolecularWeight: 397.51054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)NC(=O)CNC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)NC(=O)CNC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C23H31N3O3/c1-14(2)21(28)26-19-5-3-4-18(9-19)25-20(27)13-24-22(29)23-10-15-6-16(11-23)8-17(7-15)12-23/h3-5,9,14-17H,6-8,10-13H2,1-2H3,(H,24,29)(H,25,27)(H,26,28)