4-(3-bromophenyl)sulfonyl-N-prop-2-enyl-piperazine-1-carbothioamide

Systemtic Name: 4-(3-bromophenyl)sulfonyl-N-prop-2-enyl-piperazine-1-carbothioamide Openeye Name: N-allyl-4-(3-bromophenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: 4-(3-bromophenyl)sulfonyl-N-prop-2-enyl-1-piperazinecarbothioamide IUPAC Name: 4-(3-bromophenyl)sulfonyl-N-prop-2-enylpiperazine-1-carbothioamide Traditional Name: N-allyl-4-(3-bromophenyl)sulfonyl-piperazine-1-carbothioamide Formula: C14H18BrN3O2S2 MolecularWeight: 404.34562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18BrN3O2S2/c1-2-6-16-14(21)17-7-9-18(10-8-17)22(19,20)13-5-3-4-12(15)11-13/h2-5,11H,1,6-10H2,(H,16,21)