4-(4-ethanoylpiperazin-1-yl)benzenecarbothioamide

Systemtic Name: 4-(4-ethanoylpiperazin-1-yl)benzenecarbothioamide Openeye Name: 4-(4-acetylpiperazin-1-yl)benzenecarbothioamide CAS Name: 4-(4-acetyl-1-piperazinyl)benzenecarbothioamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)benzenecarbothioamide Traditional Name: 4-(4-acetylpiperazino)thiobenzamide Formula: C13H17N3OS MolecularWeight: 263.35858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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