N-(2-ethylphenyl)-4-thiophen-2-ylsulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-(2-ethylphenyl)-4-thiophen-2-ylsulfonyl-piperazine-1-carbothioamide Openeye Name: N-(2-ethylphenyl)-4-(2-thienylsulfonyl)piperazine-1-carbothioamide CAS Name: N-(2-ethylphenyl)-4-thiophen-2-ylsulfonyl-1-piperazinecarbothioamide IUPAC Name: N-(2-ethylphenyl)-4-thiophen-2-ylsulfonylpiperazine-1-carbothioamide Traditional Name: N-(2-ethylphenyl)-4-(2-thienylsulfonyl)piperazine-1-carbothioamide Formula: C17H21N3O2S3 MolecularWeight: 395.56254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C17H21N3O2S3/c1-2-14-6-3-4-7-15(14)18-17(23)19-9-11-20(12-10-19)25(21,22)16-8-5-13-24-16/h3-8,13H,2,9-12H2,1H3,(H,18,23)