1-[(4-chloranyl-3-methyl-phenoxy)methyl]-N-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide

Systemtic Name: 1-[(4-chloranyl-3-methyl-phenoxy)methyl]-N-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide Openeye Name: 1-[(4-chloro-3-methyl-phenoxy)methyl]-N-(3-morpholinopropyl)pyrazole-3-carboxamide CAS Name: 1-[(4-chloro-3-methylphenoxy)methyl]-N-[3-(4-morpholinyl)propyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-chloro-3-methylphenoxy)methyl]-N-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide Traditional Name: 1-[(4-chloro-3-methyl-phenoxy)methyl]-N-(3-morpholinopropyl)pyrazole-3-carboxamide Formula: C19H25ClN4O3 MolecularWeight: 392.8798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCN2C=CC(=N2)C(=O)NCCCN3CCOCC3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCN2C=CC(=N2)C(=O)NCCCN3CCOCC3)Cl

InChI

InChI=1S/C19H25ClN4O3/c1-15-13-16(3-4-17(15)20)27-14-24-8-5-18(22-24)19(25)21-6-2-7-23-9-11-26-12-10-23/h3-5,8,13H,2,6-7,9-12,14H2,1H3,(H,21,25)