N-[(2,3-dimethoxyphenyl)methyl]-2-(5-methyl-1-phenyl-pyrazol-4-yl)carbonyl-pyrazolidine-1-carbothioamide

Systemtic Name: N-[(2,3-dimethoxyphenyl)methyl]-2-(5-methyl-1-phenyl-pyrazol-4-yl)carbonyl-pyrazolidine-1-carbothioamide Openeye Name: N-[(2,3-dimethoxyphenyl)methyl]-2-(5-methyl-1-phenyl-pyrazole-4-carbonyl)pyrazolidine-1-carbothioamide CAS Name: N-[(2,3-dimethoxyphenyl)methyl]-2-[(5-methyl-1-phenyl-4-pyrazolyl)-oxomethyl]-1-pyrazolidinecarbothioamide IUPAC Name: N-[(2,3-dimethoxyphenyl)methyl]-2-(5-methyl-1-phenylpyrazole-4-carbonyl)pyrazolidine-1-carbothioamide Traditional Name: 2-(5-methyl-1-phenyl-pyrazole-4-carbonyl)-N-o-veratryl-pyrazolidine-1-carbothioamide Formula: C24H27N5O3S MolecularWeight: 465.56788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCCN3C(=S)NCC4=C(C(=CC=C4)OC)OC

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCCN3C(=S)NCC4=C(C(=CC=C4)OC)OC

InChI

InChI=1S/C24H27N5O3S/c1-17-20(16-26-29(17)19-10-5-4-6-11-19)23(30)27-13-8-14-28(27)24(33)25-15-18-9-7-12-21(31-2)22(18)32-3/h4-7,9-12,16H,8,13-15H2,1-3H3,(H,25,33)