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

Systemtic Name: 4-(2,5-dimethoxyphenyl)sulfonyl-N-propan-2-yl-piperazine-1-carbothioamide Openeye Name: 4-(2,5-dimethoxyphenyl)sulfonyl-N-isopropyl-piperazine-1-carbothioamide CAS Name: 4-(2,5-dimethoxyphenyl)sulfonyl-N-propan-2-yl-1-piperazinecarbothioamide IUPAC Name: 4-(2,5-dimethoxyphenyl)sulfonyl-N-propan-2-ylpiperazine-1-carbothioamide Traditional Name: 4-(2,5-dimethoxyphenyl)sulfonyl-N-isopropyl-piperazine-1-carbothioamide Formula: C16H25N3O4S2 MolecularWeight: 387.5174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25N3O4S2/c1-12(2)17-16(24)18-7-9-19(10-8-18)25(20,21)15-11-13(22-3)5-6-14(15)23-4/h5-6,11-12H,7-10H2,1-4H3,(H,17,24)