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

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

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2Br

Isomeric SMILES

C=CCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2Br

InChI

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