4-(1-adamantylcarbamoylamino)-1-ethyl-N-phenyl-pyrazole-3-carboxamide

Systemtic Name: 4-(1-adamantylcarbamoylamino)-1-ethyl-N-phenyl-pyrazole-3-carboxamide Openeye Name: 4-(1-adamantylcarbamoylamino)-1-ethyl-N-phenyl-pyrazole-3-carboxamide CAS Name: 4-[[(1-adamantylamino)-oxomethyl]amino]-1-ethyl-N-phenyl-3-pyrazolecarboxamide IUPAC Name: 4-(1-adamantylcarbamoylamino)-1-ethyl-N-phenylpyrazole-3-carboxamide Traditional Name: 4-(1-adamantylcarbamoylamino)-1-ethyl-N-phenyl-pyrazole-3-carboxamide Formula: C23H29N5O2 MolecularWeight: 407.50866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2=CC=CC=C2)NC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2=CC=CC=C2)NC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H29N5O2/c1-2-28-14-19(20(27-28)21(29)24-18-6-4-3-5-7-18)25-22(30)26-23-11-15-8-16(12-23)10-17(9-15)13-23/h3-7,14-17H,2,8-13H2,1H3,(H,24,29)(H2,25,26,30)