N-(2-chloranyl-4-methyl-phenyl)-2-[1-(4-methoxyphenyl)cyclopropyl]carbonyl-pyrazolidine-1-carbothioamide

Systemtic Name: N-(2-chloranyl-4-methyl-phenyl)-2-[1-(4-methoxyphenyl)cyclopropyl]carbonyl-pyrazolidine-1-carbothioamide Openeye Name: N-(2-chloro-4-methyl-phenyl)-2-[1-(4-methoxyphenyl)cyclopropanecarbonyl]pyrazolidine-1-carbothioamide CAS Name: N-(2-chloro-4-methylphenyl)-2-[[1-(4-methoxyphenyl)cyclopropyl]-oxomethyl]-1-pyrazolidinecarbothioamide IUPAC Name: N-(2-chloro-4-methylphenyl)-2-[1-(4-methoxyphenyl)cyclopropanecarbonyl]pyrazolidine-1-carbothioamide Traditional Name: N-(2-chloro-4-methyl-phenyl)-2-[1-(4-methoxyphenyl)cyclopropanecarbonyl]pyrazolidine-1-carbothioamide Formula: C22H24ClN3O2S MolecularWeight: 429.96286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)N2CCCN2C(=O)C3(CC3)C4=CC=C(C=C4)OC)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)N2CCCN2C(=O)C3(CC3)C4=CC=C(C=C4)OC)Cl

InChI

InChI=1S/C22H24ClN3O2S/c1-15-4-9-19(18(23)14-15)24-21(29)26-13-3-12-25(26)20(27)22(10-11-22)16-5-7-17(28-2)8-6-16/h4-9,14H,3,10-13H2,1-2H3,(H,24,29)