4-(3-bromophenyl)sulfonyl-N-propan-2-yl-piperazine-1-carbothioamide

Systemtic Name: 4-(3-bromophenyl)sulfonyl-N-propan-2-yl-piperazine-1-carbothioamide Openeye Name: 4-(3-bromophenyl)sulfonyl-N-isopropyl-piperazine-1-carbothioamide CAS Name: 4-(3-bromophenyl)sulfonyl-N-propan-2-yl-1-piperazinecarbothioamide IUPAC Name: 4-(3-bromophenyl)sulfonyl-N-propan-2-ylpiperazine-1-carbothioamide Traditional Name: 4-(3-bromophenyl)sulfonyl-N-isopropyl-piperazine-1-carbothioamide Formula: C14H20BrN3O2S2 MolecularWeight: 406.3615

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20BrN3O2S2/c1-11(2)16-14(21)17-6-8-18(9-7-17)22(19,20)13-5-3-4-12(15)10-13/h3-5,10-11H,6-9H2,1-2H3,(H,16,21)