N-[[4-[[3-(propylcarbamoyl)phenyl]carbamoyl]phenyl]methyl]adamantane-1-carboxamide

Systemtic Name: N-[[4-[[3-(propylcarbamoyl)phenyl]carbamoyl]phenyl]methyl]adamantane-1-carboxamide Openeye Name: N-[[4-[[3-(propylcarbamoyl)phenyl]carbamoyl]phenyl]methyl]adamantane-1-carboxamide CAS Name: N-[[4-[oxo-[3-[oxo(propylamino)methyl]anilino]methyl]phenyl]methyl]-1-adamantanecarboxamide IUPAC Name: N-[[4-[[3-(propylcarbamoyl)phenyl]carbamoyl]phenyl]methyl]adamantane-1-carboxamide Traditional Name: N-[4-[[3-(propylcarbamoyl)phenyl]carbamoyl]benzyl]adamantane-1-carboxamide Formula: C29H35N3O3 MolecularWeight: 473.6065

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)CNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCCNC(=O)C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)CNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C29H35N3O3/c1-2-10-30-26(33)24-4-3-5-25(14-24)32-27(34)23-8-6-19(7-9-23)18-31-28(35)29-15-20-11-21(16-29)13-22(12-20)17-29/h3-9,14,20-22H,2,10-13,15-18H2,1H3,(H,30,33)(H,31,35)(H,32,34)