4-(5-chloranyl-2-methyl-phenyl)-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(5-chloranyl-2-methyl-phenyl)-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide Openeye Name: 4-(5-chloro-2-methyl-phenyl)-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide CAS Name: 4-(5-chloro-2-methylphenyl)-N-(4-sulfamoylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(5-chloro-2-methylphenyl)-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide Traditional Name: 4-(5-chloro-2-methyl-phenyl)-N-(4-sulfamoylphenyl)piperazine-1-carbothioamide Formula: C18H21ClN4O2S2 MolecularWeight: 424.96794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21ClN4O2S2/c1-13-2-3-14(19)12-17(13)22-8-10-23(11-9-22)18(26)21-15-4-6-16(7-5-15)27(20,24)25/h2-7,12H,8-11H2,1H3,(H,21,26)(H2,20,24,25)