4-(4-methylphenyl)sulfonyl-N-(4-propan-2-ylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(4-methylphenyl)sulfonyl-N-(4-propan-2-ylphenyl)piperazine-1-carbothioamide Openeye Name: N-(4-isopropylphenyl)-4-(p-tolylsulfonyl)piperazine-1-carbothioamide CAS Name: 4-(4-methylphenyl)sulfonyl-N-(4-propan-2-ylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-methylphenyl)sulfonyl-N-(4-propan-2-ylphenyl)piperazine-1-carbothioamide Traditional Name: N-p-cumenyl-4-tosyl-piperazine-1-carbothioamide Formula: C21H27N3O2S2 MolecularWeight: 417.58798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NC3=CC=C(C=C3)C(C)C

InChI

InChI=1S/C21H27N3O2S2/c1-16(2)18-6-8-19(9-7-18)22-21(27)23-12-14-24(15-13-23)28(25,26)20-10-4-17(3)5-11-20/h4-11,16H,12-15H2,1-3H3,(H,22,27)