3-(4-methylpiperazin-1-yl)sulfonylbenzenecarbothioamide

Systemtic Name: 3-(4-methylpiperazin-1-yl)sulfonylbenzenecarbothioamide Openeye Name: 3-(4-methylpiperazin-1-yl)sulfonylbenzenecarbothioamide CAS Name: 3-[(4-methyl-1-piperazinyl)sulfonyl]benzenecarbothioamide IUPAC Name: 3-(4-methylpiperazin-1-yl)sulfonylbenzenecarbothioamide Traditional Name: 3-(4-methylpiperazino)sulfonylthiobenzamide Formula: C12H17N3O2S2 MolecularWeight: 299.41228

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=S)N

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=S)N

InChI

InChI=1S/C12H17N3O2S2/c1-14-5-7-15(8-6-14)19(16,17)11-4-2-3-10(9-11)12(13)18/h2-4,9H,5-8H2,1H3,(H2,13,18)