3-(2,3-dimethoxyphenyl)-N-phenyl-5-thiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide

Systemtic Name: 3-(2,3-dimethoxyphenyl)-N-phenyl-5-thiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide Openeye Name: 3-(2,3-dimethoxyphenyl)-N-phenyl-5-(2-thienyl)-3,4-dihydropyrazole-2-carbothioamide CAS Name: 3-(2,3-dimethoxyphenyl)-N-phenyl-5-thiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide IUPAC Name: 3-(2,3-dimethoxyphenyl)-N-phenyl-5-thiophen-2-yl-3,4-dihydropyrazole-2-carbothioamide Traditional Name: 5-(2,3-dimethoxyphenyl)-N-phenyl-3-(2-thienyl)-2-pyrazoline-1-carbothioamide Formula: C22H21N3O2S2 MolecularWeight: 423.55104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C2CC(=NN2C(=S)NC3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

COC1=CC=CC(=C1OC)C2CC(=NN2C(=S)NC3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C22H21N3O2S2/c1-26-19-11-6-10-16(21(19)27-2)18-14-17(20-12-7-13-29-20)24-25(18)22(28)23-15-8-4-3-5-9-15/h3-13,18H,14H2,1-2H3,(H,23,28)