5-chloranyl-3-methyl-1-phenyl-N-[(1-phenylcyclobutyl)methyl]pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-3-methyl-1-phenyl-N-[(1-phenylcyclobutyl)methyl]pyrazole-4-carboxamide Openeye Name: 5-chloro-3-methyl-1-phenyl-N-[(1-phenylcyclobutyl)methyl]pyrazole-4-carboxamide CAS Name: 5-chloro-3-methyl-1-phenyl-N-[(1-phenylcyclobutyl)methyl]-4-pyrazolecarboxamide IUPAC Name: 5-chloro-3-methyl-1-phenyl-N-[(1-phenylcyclobutyl)methyl]pyrazole-4-carboxamide Traditional Name: 5-chloro-3-methyl-1-phenyl-N-[(1-phenylcyclobutyl)methyl]pyrazole-4-carboxamide Formula: C22H22ClN3O MolecularWeight: 379.88258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCC2(CCC2)C3=CC=CC=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCC2(CCC2)C3=CC=CC=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H22ClN3O/c1-16-19(20(23)26(25-16)18-11-6-3-7-12-18)21(27)24-15-22(13-8-14-22)17-9-4-2-5-10-17/h2-7,9-12H,8,13-15H2,1H3,(H,24,27)