4-(3-oxidanylidenepiperazin-1-yl)benzenecarbothioamide

Systemtic Name: 4-(3-oxidanylidenepiperazin-1-yl)benzenecarbothioamide Openeye Name: 4-(3-oxopiperazin-1-yl)benzenecarbothioamide CAS Name: 4-(3-oxo-1-piperazinyl)benzenecarbothioamide IUPAC Name: 4-(3-oxopiperazin-1-yl)benzenecarbothioamide Traditional Name: 4-(3-ketopiperazino)thiobenzamide Formula: C11H13N3OS MolecularWeight: 235.30542

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=CC=C(C=C2)C(=S)N

Isomeric SMILES

C1CN(CC(=O)N1)C2=CC=C(C=C2)C(=S)N

InChI

InChI=1S/C11H13N3OS/c12-11(16)8-1-3-9(4-2-8)14-6-5-13-10(15)7-14/h1-4H,5-7H2,(H2,12,16)(H,13,15)