N-(4-bromanyl-3-methyl-phenyl)-4-methanoyl-piperazine-1-carbothioamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-4-methanoyl-piperazine-1-carbothioamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-4-formyl-piperazine-1-carbothioamide CAS Name: N-(4-bromo-3-methylphenyl)-4-formyl-1-piperazinecarbothioamide IUPAC Name: N-(4-bromo-3-methylphenyl)-4-formylpiperazine-1-carbothioamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-4-formyl-piperazine-1-carbothioamide Formula: C13H16BrN3OS MolecularWeight: 342.25464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=S)N2CCN(CC2)C=O)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=S)N2CCN(CC2)C=O)Br

InChI

InChI=1S/C13H16BrN3OS/c1-10-8-11(2-3-12(10)14)15-13(19)17-6-4-16(9-18)5-7-17/h2-3,8-9H,4-7H2,1H3,(H,15,19)