N-[1-[[2-(dimethylaminomethyl)phenyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[1-[[2-(dimethylaminomethyl)phenyl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[1-[[2-(dimethylaminomethyl)phenyl]carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide CAS Name: N-[1-[2-(dimethylaminomethyl)anilino]-3-methyl-1-oxobutan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[1-[2-(dimethylaminomethyl)anilino]-3-methyl-1-oxobutan-2-yl]adamantane-1-carboxamide Traditional Name: N-[1-[[2-(dimethylaminomethyl)phenyl]carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide Formula: C25H37N3O2 MolecularWeight: 411.58018

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=CC=C1CN(C)C)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)C(C(=O)NC1=CC=CC=C1CN(C)C)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C25H37N3O2/c1-16(2)22(23(29)26-21-8-6-5-7-20(21)15-28(3)4)27-24(30)25-12-17-9-18(13-25)11-19(10-17)14-25/h5-8,16-19,22H,9-15H2,1-4H3,(H,26,29)(H,27,30)