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

Systemtic Name: N-(2-methylphenyl)-4-(4-methylphenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: N-(o-tolyl)-4-(p-tolylsulfonyl)piperazine-1-carbothioamide CAS Name: N-(2-methylphenyl)-4-(4-methylphenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-(2-methylphenyl)-4-(4-methylphenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-(o-tolyl)-4-tosyl-piperazine-1-carbothioamide Formula: C19H23N3O2S2 MolecularWeight: 389.53482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NC3=CC=CC=C3C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NC3=CC=CC=C3C

InChI

InChI=1S/C19H23N3O2S2/c1-15-7-9-17(10-8-15)26(23,24)22-13-11-21(12-14-22)19(25)20-18-6-4-3-5-16(18)2/h3-10H,11-14H2,1-2H3,(H,20,25)