4-(5-chloranylthiophen-2-yl)sulfonyl-N-(2-methylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-(5-chloranylthiophen-2-yl)sulfonyl-N-(2-methylphenyl)piperazine-1-carbothioamide Openeye Name: 4-[(5-chloro-2-thienyl)sulfonyl]-N-(o-tolyl)piperazine-1-carbothioamide CAS Name: 4-[(5-chloro-2-thiophenyl)sulfonyl]-N-(2-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(5-chlorothiophen-2-yl)sulfonyl-N-(2-methylphenyl)piperazine-1-carbothioamide Traditional Name: 4-[(5-chloro-2-thienyl)sulfonyl]-N-(o-tolyl)piperazine-1-carbothioamide Formula: C16H18ClN3O2S3 MolecularWeight: 415.98102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CC1=CC=CC=C1NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C16H18ClN3O2S3/c1-12-4-2-3-5-13(12)18-16(23)19-8-10-20(11-9-19)25(21,22)15-7-6-14(17)24-15/h2-7H,8-11H2,1H3,(H,18,23)