N-[1-[[1-[(4-chlorophenyl)methyl]piperidin-4-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide

Systemtic Name: N-[1-[[1-[(4-chlorophenyl)methyl]piperidin-4-yl]amino]-3-methyl-1-oxidanylidene-butan-2-yl]adamantane-1-carboxamide Openeye Name: N-[1-[[1-[(4-chlorophenyl)methyl]-4-piperidyl]carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide CAS Name: N-[1-[[1-[(4-chlorophenyl)methyl]-4-piperidinyl]amino]-3-methyl-1-oxobutan-2-yl]-1-adamantanecarboxamide IUPAC Name: N-[1-[[1-[(4-chlorophenyl)methyl]piperidin-4-yl]amino]-3-methyl-1-oxobutan-2-yl]adamantane-1-carboxamide Traditional Name: N-[1-[[1-(4-chlorobenzyl)-4-piperidyl]carbamoyl]-2-methyl-propyl]adamantane-1-carboxamide Formula: C28H40ClN3O2 MolecularWeight: 486.0891

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1CCN(CC1)CC2=CC=C(C=C2)Cl)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C)C(C(=O)NC1CCN(CC1)CC2=CC=C(C=C2)Cl)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C28H40ClN3O2/c1-18(2)25(31-27(34)28-14-20-11-21(15-28)13-22(12-20)16-28)26(33)30-24-7-9-32(10-8-24)17-19-3-5-23(29)6-4-19/h3-6,18,20-22,24-25H,7-17H2,1-2H3,(H,30,33)(H,31,34)