4-(2,5-dimethoxyphenyl)sulfonyl-N-(2-methoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(2,5-dimethoxyphenyl)sulfonyl-N-(2-methoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-(2,5-dimethoxyphenyl)sulfonyl-N-(2-methoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-(2,5-dimethoxyphenyl)sulfonyl-N-(2-methoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(2,5-dimethoxyphenyl)sulfonyl-N-(2-methoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-(2,5-dimethoxyphenyl)sulfonyl-N-(2-methoxyphenyl)piperazine-1-carbothioamide Formula: C20H25N3O5S2 MolecularWeight: 451.5596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C(=S)NC3=CC=CC=C3OC

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C(=S)NC3=CC=CC=C3OC

InChI

InChI=1S/C20H25N3O5S2/c1-26-15-8-9-18(28-3)19(14-15)30(24,25)23-12-10-22(11-13-23)20(29)21-16-6-4-5-7-17(16)27-2/h4-9,14H,10-13H2,1-3H3,(H,21,29)