N-[(2S)-5-(diethylamino)pentan-2-yl]-2-(2,4-dimethylphenyl)-5-phenyl-pyrazole-3-carboxamide

Systemtic Name: N-[(2S)-5-(diethylamino)pentan-2-yl]-2-(2,4-dimethylphenyl)-5-phenyl-pyrazole-3-carboxamide Openeye Name: N-[(1S)-4-(diethylamino)-1-methyl-butyl]-2-(2,4-dimethylphenyl)-5-phenyl-pyrazole-3-carboxamide CAS Name: N-[(2S)-5-(diethylamino)pentan-2-yl]-2-(2,4-dimethylphenyl)-5-phenyl-3-pyrazolecarboxamide IUPAC Name: N-[(2S)-5-(diethylamino)pentan-2-yl]-2-(2,4-dimethylphenyl)-5-phenylpyrazole-3-carboxamide Traditional Name: N-[(1S)-4-(diethylamino)-1-methyl-butyl]-2-(2,4-dimethylphenyl)-5-phenyl-pyrazole-3-carboxamide Formula: C27H36N4O MolecularWeight: 432.60094

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)NC(=O)C1=CC(=NN1C2=C(C=C(C=C2)C)C)C3=CC=CC=C3

Isomeric SMILES

CCN(CC)CCC[C@H](C)NC(=O)C1=CC(=NN1C2=C(C=C(C=C2)C)C)C3=CC=CC=C3

InChI

InChI=1S/C27H36N4O/c1-6-30(7-2)17-11-12-22(5)28-27(32)26-19-24(23-13-9-8-10-14-23)29-31(26)25-16-15-20(3)18-21(25)4/h8-10,13-16,18-19,22H,6-7,11-12,17H2,1-5H3,(H,28,32)/t22-/m0/s1