4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-N-(2,4-dimethoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-N-(2,4-dimethoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-[4-(4-chlorophenyl)thiazol-2-yl]-N-(2,4-dimethoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-[4-(4-chlorophenyl)-2-thiazolyl]-N-(2,4-dimethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-N-(2,4-dimethoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-[4-(4-chlorophenyl)thiazol-2-yl]-N-(2,4-dimethoxyphenyl)piperazine-1-carbothioamide Formula: C22H23ClN4O2S2 MolecularWeight: 475.02662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=S)N2CCN(CC2)C3=NC(=CS3)C4=CC=C(C=C4)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=S)N2CCN(CC2)C3=NC(=CS3)C4=CC=C(C=C4)Cl)OC

InChI

InChI=1S/C22H23ClN4O2S2/c1-28-17-7-8-18(20(13-17)29-2)24-21(30)26-9-11-27(12-10-26)22-25-19(14-31-22)15-3-5-16(23)6-4-15/h3-8,13-14H,9-12H2,1-2H3,(H,24,30)