N-(3-chloranyl-2-methyl-phenyl)-4-(4-methylphenyl)sulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-4-(4-methylphenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-4-(p-tolylsulfonyl)piperazine-1-carbothioamide CAS Name: N-(3-chloro-2-methylphenyl)-4-(4-methylphenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-(3-chloro-2-methylphenyl)-4-(4-methylphenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-4-tosyl-piperazine-1-carbothioamide Formula: C19H22ClN3O2S2 MolecularWeight: 423.97988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22ClN3O2S2/c1-14-6-8-16(9-7-14)27(24,25)23-12-10-22(11-13-23)19(26)21-18-5-3-4-17(20)15(18)2/h3-9H,10-13H2,1-2H3,(H,21,26)