4-[2,5-bis(bromanyl)phenyl]sulfonyl-N-(2-dimethylaminoethyl)piperazine-1-carbothioamide

Systemtic Name: 4-[2,5-bis(bromanyl)phenyl]sulfonyl-N-(2-dimethylaminoethyl)piperazine-1-carbothioamide Openeye Name: 4-(2,5-dibromophenyl)sulfonyl-N-(2-dimethylaminoethyl)piperazine-1-carbothioamide CAS Name: 4-(2,5-dibromophenyl)sulfonyl-N-(2-dimethylaminoethyl)-1-piperazinecarbothioamide IUPAC Name: 4-(2,5-dibromophenyl)sulfonyl-N-(2-dimethylaminoethyl)piperazine-1-carbothioamide Traditional Name: 4-(2,5-dibromophenyl)sulfonyl-N-(2-dimethylaminoethyl)piperazine-1-carbothioamide Formula: C15H22Br2N4O2S2 MolecularWeight: 514.29878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC(=S)N1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)Br)Br

Isomeric SMILES

CN(C)CCNC(=S)N1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)Br)Br

InChI

InChI=1S/C15H22Br2N4O2S2/c1-19(2)6-5-18-15(24)20-7-9-21(10-8-20)25(22,23)14-11-12(16)3-4-13(14)17/h3-4,11H,5-10H2,1-2H3,(H,18,24)