N-(3-bromophenyl)-4-methyl-piperazine-1-carbothioamide

Systemtic Name: N-(3-bromophenyl)-4-methyl-piperazine-1-carbothioamide Openeye Name: N-(3-bromophenyl)-4-methyl-piperazine-1-carbothioamide CAS Name: N-(3-bromophenyl)-4-methyl-1-piperazinecarbothioamide IUPAC Name: N-(3-bromophenyl)-4-methylpiperazine-1-carbothioamide Traditional Name: N-(3-bromophenyl)-4-methyl-piperazine-1-carbothioamide Formula: C12H16BrN3S MolecularWeight: 314.24454

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=S)NC2=CC(=CC=C2)Br

Isomeric SMILES

CN1CCN(CC1)C(=S)NC2=CC(=CC=C2)Br

InChI

InChI=1S/C12H16BrN3S/c1-15-5-7-16(8-6-15)12(17)14-11-4-2-3-10(13)9-11/h2-4,9H,5-8H2,1H3,(H,14,17)