N-propan-2-yl-4-(2,4,6-trimethylphenyl)sulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-propan-2-yl-4-(2,4,6-trimethylphenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: N-isopropyl-4-(2,4,6-trimethylphenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: N-propan-2-yl-4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-propan-2-yl-4-(2,4,6-trimethylphenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-isopropyl-4-mesitylsulfonyl-piperazine-1-carbothioamide Formula: C17H27N3O2S2 MolecularWeight: 369.54518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=S)NC(C)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCN(CC2)C(=S)NC(C)C)C

InChI

InChI=1S/C17H27N3O2S2/c1-12(2)18-17(23)19-6-8-20(9-7-19)24(21,22)16-14(4)10-13(3)11-15(16)5/h10-12H,6-9H2,1-5H3,(H,18,23)