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

Systemtic Name: 4-(3-bromophenyl)sulfonyl-N-(2-methoxyethyl)piperazine-1-carbothioamide Openeye Name: 4-(3-bromophenyl)sulfonyl-N-(2-methoxyethyl)piperazine-1-carbothioamide CAS Name: 4-(3-bromophenyl)sulfonyl-N-(2-methoxyethyl)-1-piperazinecarbothioamide IUPAC Name: 4-(3-bromophenyl)sulfonyl-N-(2-methoxyethyl)piperazine-1-carbothioamide Traditional Name: 4-(3-bromophenyl)sulfonyl-N-(2-methoxyethyl)piperazine-1-carbothioamide Formula: C14H20BrN3O3S2 MolecularWeight: 422.3609

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20BrN3O3S2/c1-21-10-5-16-14(22)17-6-8-18(9-7-17)23(19,20)13-4-2-3-12(15)11-13/h2-4,11H,5-10H2,1H3,(H,16,22)