4-(3-bromophenyl)sulfonyl-N-(3-ethoxypropyl)piperazine-1-carbothioamide

Systemtic Name: 4-(3-bromophenyl)sulfonyl-N-(3-ethoxypropyl)piperazine-1-carbothioamide Openeye Name: 4-(3-bromophenyl)sulfonyl-N-(3-ethoxypropyl)piperazine-1-carbothioamide CAS Name: 4-(3-bromophenyl)sulfonyl-N-(3-ethoxypropyl)-1-piperazinecarbothioamide IUPAC Name: 4-(3-bromophenyl)sulfonyl-N-(3-ethoxypropyl)piperazine-1-carbothioamide Traditional Name: 4-(3-bromophenyl)sulfonyl-N-(3-ethoxypropyl)piperazine-1-carbothioamide Formula: C16H24BrN3O3S2 MolecularWeight: 450.41406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

CCOCCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C16H24BrN3O3S2/c1-2-23-12-4-7-18-16(24)19-8-10-20(11-9-19)25(21,22)15-6-3-5-14(17)13-15/h3,5-6,13H,2,4,7-12H2,1H3,(H,18,24)