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

Systemtic Name: 1-[(4-chloranyl-3-methyl-phenoxy)methyl]-N-(3-imidazol-1-ylpropyl)pyrazole-3-carboxamide Openeye Name: 1-[(4-chloro-3-methyl-phenoxy)methyl]-N-(3-imidazol-1-ylpropyl)pyrazole-3-carboxamide CAS Name: 1-[(4-chloro-3-methylphenoxy)methyl]-N-[3-(1-imidazolyl)propyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-chloro-3-methylphenoxy)methyl]-N-(3-imidazol-1-ylpropyl)pyrazole-3-carboxamide Traditional Name: 1-[(4-chloro-3-methyl-phenoxy)methyl]-N-(3-imidazol-1-ylpropyl)pyrazole-3-carboxamide Formula: C18H20ClN5O2 MolecularWeight: 373.8367

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCN2C=CC(=N2)C(=O)NCCCN3C=CN=C3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCN2C=CC(=N2)C(=O)NCCCN3C=CN=C3)Cl

InChI

InChI=1S/C18H20ClN5O2/c1-14-11-15(3-4-16(14)19)26-13-24-9-5-17(22-24)18(25)21-6-2-8-23-10-7-20-12-23/h3-5,7,9-12H,2,6,8,13H2,1H3,(H,21,25)