2-(4-ethanoylpiperazin-1-yl)sulfonylbenzenecarbothioamide

Systemtic Name: 2-(4-ethanoylpiperazin-1-yl)sulfonylbenzenecarbothioamide Openeye Name: 2-(4-acetylpiperazin-1-yl)sulfonylbenzenecarbothioamide CAS Name: 2-[(4-acetyl-1-piperazinyl)sulfonyl]benzenecarbothioamide IUPAC Name: 2-(4-acetylpiperazin-1-yl)sulfonylbenzenecarbothioamide Traditional Name: 2-(4-acetylpiperazino)sulfonylthiobenzamide Formula: C13H17N3O3S2 MolecularWeight: 327.42238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=S)N

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=S)N

InChI

InChI=1S/C13H17N3O3S2/c1-10(17)15-6-8-16(9-7-15)21(18,19)12-5-3-2-4-11(12)13(14)20/h2-5H,6-9H2,1H3,(H2,14,20)