1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-(2-methyl-2-morpholin-4-yl-propyl)urea

Systemtic Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-(2-methyl-2-morpholin-4-yl-propyl)urea Openeye Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-(2-methyl-2-morpholino-propyl)urea CAS Name: 1-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-3-[2-methyl-2-(4-morpholinyl)propyl]urea IUPAC Name: 1-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-3-(2-methyl-2-morpholin-4-ylpropyl)urea Traditional Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-3-(2-methyl-2-morpholino-propyl)urea Formula: C21H31N5O2 MolecularWeight: 385.50314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)NCC(C)(C)N3CCOCC3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CNC(=O)NCC(C)(C)N3CCOCC3

InChI

InChI=1S/C21H31N5O2/c1-16-19(17(2)26(24-16)18-8-6-5-7-9-18)14-22-20(27)23-15-21(3,4)25-10-12-28-13-11-25/h5-9H,10-15H2,1-4H3,(H2,22,23,27)