N-[4-oxidanylidene-4-[[4-(phenylcarbamoylamino)phenyl]amino]butyl]adamantane-1-carboxamide

Systemtic Name: N-[4-oxidanylidene-4-[[4-(phenylcarbamoylamino)phenyl]amino]butyl]adamantane-1-carboxamide Openeye Name: N-[4-oxo-4-[4-(phenylcarbamoylamino)anilino]butyl]adamantane-1-carboxamide CAS Name: N-[4-[4-[[anilino(oxo)methyl]amino]anilino]-4-oxobutyl]-1-adamantanecarboxamide IUPAC Name: N-[4-oxo-4-[4-(phenylcarbamoylamino)anilino]butyl]adamantane-1-carboxamide Traditional Name: N-[4-keto-4-[4-(phenylcarbamoylamino)anilino]butyl]adamantane-1-carboxamide Formula: C28H34N4O3 MolecularWeight: 474.59456

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NCCCC(=O)NC4=CC=C(C=C4)NC(=O)NC5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NCCCC(=O)NC4=CC=C(C=C4)NC(=O)NC5=CC=CC=C5

InChI

InChI=1S/C28H34N4O3/c33-25(7-4-12-29-26(34)28-16-19-13-20(17-28)15-21(14-19)18-28)30-23-8-10-24(11-9-23)32-27(35)31-22-5-2-1-3-6-22/h1-3,5-6,8-11,19-21H,4,7,12-18H2,(H,29,34)(H,30,33)(H2,31,32,35)