N-[(2,3-dimethoxyphenyl)methyl]-2-[(2-pyridin-3-yl-1,3-thiazol-4-yl)carbonyl]pyrazolidine-1-carbothioamide

Systemtic Name: N-[(2,3-dimethoxyphenyl)methyl]-2-[(2-pyridin-3-yl-1,3-thiazol-4-yl)carbonyl]pyrazolidine-1-carbothioamide Openeye Name: N-[(2,3-dimethoxyphenyl)methyl]-2-[2-(3-pyridyl)thiazole-4-carbonyl]pyrazolidine-1-carbothioamide CAS Name: N-[(2,3-dimethoxyphenyl)methyl]-2-[oxo-[2-(3-pyridinyl)-4-thiazolyl]methyl]-1-pyrazolidinecarbothioamide IUPAC Name: N-[(2,3-dimethoxyphenyl)methyl]-2-(2-pyridin-3-yl-1,3-thiazole-4-carbonyl)pyrazolidine-1-carbothioamide Traditional Name: N-o-veratryl-2-[2-(3-pyridyl)thiazole-4-carbonyl]pyrazolidine-1-carbothioamide Formula: C22H23N5O3S2 MolecularWeight: 469.57972

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CNC(=S)N2CCCN2C(=O)C3=CSC(=N3)C4=CN=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1OC)CNC(=S)N2CCCN2C(=O)C3=CSC(=N3)C4=CN=CC=C4

InChI

InChI=1S/C22H23N5O3S2/c1-29-18-8-3-6-15(19(18)30-2)13-24-22(31)27-11-5-10-26(27)21(28)17-14-32-20(25-17)16-7-4-9-23-12-16/h3-4,6-9,12,14H,5,10-11,13H2,1-2H3,(H,24,31)