1-[(2-chloranylphenoxy)methyl]-N-[(1S)-1-(4-methylphenyl)propyl]pyrazole-3-carboxamide

Systemtic Name: 1-[(2-chloranylphenoxy)methyl]-N-[(1S)-1-(4-methylphenyl)propyl]pyrazole-3-carboxamide Openeye Name: 1-[(2-chlorophenoxy)methyl]-N-[(1S)-1-(p-tolyl)propyl]pyrazole-3-carboxamide CAS Name: 1-[(2-chlorophenoxy)methyl]-N-[(1S)-1-(4-methylphenyl)propyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(2-chlorophenoxy)methyl]-N-[(1S)-1-(4-methylphenyl)propyl]pyrazole-3-carboxamide Traditional Name: 1-[(2-chlorophenoxy)methyl]-N-[(1S)-1-(p-tolyl)propyl]pyrazole-3-carboxamide Formula: C21H22ClN3O2 MolecularWeight: 383.87128

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)C)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3Cl

Isomeric SMILES

CC[C@@H](C1=CC=C(C=C1)C)NC(=O)C2=NN(C=C2)COC3=CC=CC=C3Cl

InChI

InChI=1S/C21H22ClN3O2/c1-3-18(16-10-8-15(2)9-11-16)23-21(26)19-12-13-25(24-19)14-27-20-7-5-4-6-17(20)22/h4-13,18H,3,14H2,1-2H3,(H,23,26)/t18-/m0/s1