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

Systemtic Name: N-(3-bromophenyl)-4-methanoyl-piperazine-1-carbothioamide Openeye Name: N-(3-bromophenyl)-4-formyl-piperazine-1-carbothioamide CAS Name: N-(3-bromophenyl)-4-formyl-1-piperazinecarbothioamide IUPAC Name: N-(3-bromophenyl)-4-formylpiperazine-1-carbothioamide Traditional Name: N-(3-bromophenyl)-4-formyl-piperazine-1-carbothioamide Formula: C12H14BrN3OS MolecularWeight: 328.22806

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)C(=S)NC2=CC(=CC=C2)Br

Isomeric SMILES

C1CN(CCN1C=O)C(=S)NC2=CC(=CC=C2)Br

InChI

InChI=1S/C12H14BrN3OS/c13-10-2-1-3-11(8-10)14-12(18)16-6-4-15(9-17)5-7-16/h1-3,8-9H,4-7H2,(H,14,18)