(4S,5S)-4-[N-(4-methoxyphenyl)-C-methyl-carbonimidoyl]-5-methyl-2,5-diphenyl-pyrazolidin-3-one

Systemtic Name: (4S,5S)-4-[N-(4-methoxyphenyl)-C-methyl-carbonimidoyl]-5-methyl-2,5-diphenyl-pyrazolidin-3-one Openeye Name: (4S,5S)-4-[N-(4-methoxyphenyl)-C-methyl-carbonimidoyl]-5-methyl-2,5-diphenyl-pyrazolidin-3-one CAS Name: (4S,5S)-4-[1-(4-methoxyphenyl)iminoethyl]-5-methyl-2,5-diphenyl-3-pyrazolidinone IUPAC Name: (4S,5S)-4-[N-(4-methoxyphenyl)-C-methylcarbonimidoyl]-5-methyl-2,5-diphenylpyrazolidin-3-one Traditional Name: (4S,5S)-4-[N-(4-methoxyphenyl)-C-methyl-carbonimidoyl]-5-methyl-2,5-diphenyl-pyrazolidin-3-one Formula: C25H25N3O2 MolecularWeight: 399.4849

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC1=CC=C(C=C1)OC)C2C(=O)N(NC2(C)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=NC1=CC=C(C=C1)OC)[C@H]2C(=O)N(N[C@]2(C)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H25N3O2/c1-18(26-20-14-16-22(30-3)17-15-20)23-24(29)28(21-12-8-5-9-13-21)27-25(23,2)19-10-6-4-7-11-19/h4-17,23,27H,1-3H3/t23-,25+/m0/s1