4-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonylbenzenecarbothioamide

Systemtic Name: 4-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonylbenzenecarbothioamide Openeye Name: 4-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonylbenzenecarbothioamide CAS Name: 4-[[4-(2-hydroxyethyl)-1-piperazinyl]sulfonyl]benzenecarbothioamide IUPAC Name: 4-[4-(2-hydroxyethyl)piperazin-1-yl]sulfonylbenzenecarbothioamide Traditional Name: 4-[4-(2-hydroxyethyl)piperazino]sulfonylthiobenzamide Formula: C13H19N3O3S2 MolecularWeight: 329.43826

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)S(=O)(=O)C2=CC=C(C=C2)C(=S)N

Isomeric SMILES

C1CN(CCN1CCO)S(=O)(=O)C2=CC=C(C=C2)C(=S)N

InChI

InChI=1S/C13H19N3O3S2/c14-13(20)11-1-3-12(4-2-11)21(18,19)16-7-5-15(6-8-16)9-10-17/h1-4,17H,5-10H2,(H2,14,20)