4-(4-methylphenyl)sulfonyl-N-(thiophen-2-ylmethyl)piperazine-1-carbothioamide

Systemtic Name: 4-(4-methylphenyl)sulfonyl-N-(thiophen-2-ylmethyl)piperazine-1-carbothioamide Openeye Name: 4-(p-tolylsulfonyl)-N-(2-thienylmethyl)piperazine-1-carbothioamide CAS Name: 4-(4-methylphenyl)sulfonyl-N-(thiophen-2-ylmethyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-methylphenyl)sulfonyl-N-(thiophen-2-ylmethyl)piperazine-1-carbothioamide Traditional Name: N-(2-thenyl)-4-tosyl-piperazine-1-carbothioamide Formula: C17H21N3O2S3 MolecularWeight: 395.56254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NCC3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NCC3=CC=CS3

InChI

InChI=1S/C17H21N3O2S3/c1-14-4-6-16(7-5-14)25(21,22)20-10-8-19(9-11-20)17(23)18-13-15-3-2-12-24-15/h2-7,12H,8-11,13H2,1H3,(H,18,23)