methyl 4-(phenylcarbonyl)piperazine-1-carboximidothioate

Systemtic Name: methyl 4-(phenylcarbonyl)piperazine-1-carboximidothioate Openeye Name: methyl 4-benzoylpiperazine-1-carboximidothioate CAS Name: 4-benzoyl-1-piperazinecarboximidothioic acid methyl ester IUPAC Name: methyl 4-benzoylpiperazine-1-carboximidothioate Traditional Name: 4-benzoylpiperazine-1-carboximidothioic acid methyl ester Formula: C13H17N3OS MolecularWeight: 263.35858

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=N)N1CCN(CC1)C(=O)C2=CC=CC=C2

Isomeric SMILES

CSC(=N)N1CCN(CC1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H17N3OS/c1-18-13(14)16-9-7-15(8-10-16)12(17)11-5-3-2-4-6-11/h2-6,14H,7-10H2,1H3