4-(3,4-dimethoxyphenyl)sulfonyl-N-(2-methylprop-2-enyl)piperazine-1-carbothioamide

Systemtic Name: 4-(3,4-dimethoxyphenyl)sulfonyl-N-(2-methylprop-2-enyl)piperazine-1-carbothioamide Openeye Name: 4-(3,4-dimethoxyphenyl)sulfonyl-N-(2-methylallyl)piperazine-1-carbothioamide CAS Name: 4-(3,4-dimethoxyphenyl)sulfonyl-N-(2-methylprop-2-enyl)-1-piperazinecarbothioamide IUPAC Name: 4-(3,4-dimethoxyphenyl)sulfonyl-N-(2-methylprop-2-enyl)piperazine-1-carbothioamide Traditional Name: 4-(3,4-dimethoxyphenyl)sulfonyl-N-(2-methylallyl)piperazine-1-carbothioamide Formula: C17H25N3O4S2 MolecularWeight: 399.5281

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(=C)CNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C17H25N3O4S2/c1-13(2)12-18-17(25)19-7-9-20(10-8-19)26(21,22)14-5-6-15(23-3)16(11-14)24-4/h5-6,11H,1,7-10,12H2,2-4H3,(H,18,25)