N-[4-(cyclopropylcarbamoylamino)phenyl]adamantane-1-carboxamide

Systemtic Name: N-[4-(cyclopropylcarbamoylamino)phenyl]adamantane-1-carboxamide Openeye Name: N-[4-(cyclopropylcarbamoylamino)phenyl]adamantane-1-carboxamide CAS Name: N-[4-[[(cyclopropylamino)-oxomethyl]amino]phenyl]-1-adamantanecarboxamide IUPAC Name: N-[4-(cyclopropylcarbamoylamino)phenyl]adamantane-1-carboxamide Traditional Name: N-[4-(cyclopropylcarbamoylamino)phenyl]adamantane-1-carboxamide Formula: C21H27N3O2 MolecularWeight: 353.45798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)NC2=CC=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CC1NC(=O)NC2=CC=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H27N3O2/c25-19(21-10-13-7-14(11-21)9-15(8-13)12-21)22-16-1-3-17(4-2-16)23-20(26)24-18-5-6-18/h1-4,13-15,18H,5-12H2,(H,22,25)(H2,23,24,26)