(4S)-4-[[[1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methylamino]methyl]-1-ethyl-pyrrolidin-2-one

Systemtic Name: (4S)-4-[[[1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methylamino]methyl]-1-ethyl-pyrrolidin-2-one Openeye Name: (4S)-4-[[[1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methylamino]methyl]-1-ethyl-pyrrolidin-2-one CAS Name: (4S)-4-[[[1-(2,5-dimethylphenyl)-3-phenyl-4-pyrazolyl]methylamino]methyl]-1-ethyl-2-pyrrolidinone IUPAC Name: (4S)-4-[[[1-(2,5-dimethylphenyl)-3-phenylpyrazol-4-yl]methylamino]methyl]-1-ethylpyrrolidin-2-one Traditional Name: (4S)-4-[[[1-(2,5-dimethylphenyl)-3-phenyl-pyrazol-4-yl]methylamino]methyl]-1-ethyl-2-pyrrolidone Formula: C25H30N4O MolecularWeight: 402.5319

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC(CC1=O)CNCC2=CN(N=C2C3=CC=CC=C3)C4=C(C=CC(=C4)C)C

Isomeric SMILES

CCN1C[C@@H](CC1=O)CNCC2=CN(N=C2C3=CC=CC=C3)C4=C(C=CC(=C4)C)C

InChI

InChI=1S/C25H30N4O/c1-4-28-16-20(13-24(28)30)14-26-15-22-17-29(23-12-18(2)10-11-19(23)3)27-25(22)21-8-6-5-7-9-21/h5-12,17,20,26H,4,13-16H2,1-3H3/t20-/m0/s1