4-(4-ethanoylphenyl)sulfonyl-N-methyl-piperazine-1-carbothioamide

Systemtic Name: 4-(4-ethanoylphenyl)sulfonyl-N-methyl-piperazine-1-carbothioamide Openeye Name: 4-(4-acetylphenyl)sulfonyl-N-methyl-piperazine-1-carbothioamide CAS Name: 4-(4-acetylphenyl)sulfonyl-N-methyl-1-piperazinecarbothioamide IUPAC Name: 4-(4-acetylphenyl)sulfonyl-N-methylpiperazine-1-carbothioamide Traditional Name: 4-(4-acetylphenyl)sulfonyl-N-methyl-piperazine-1-carbothioamide Formula: C14H19N3O3S2 MolecularWeight: 341.44896

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NC

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=S)NC

InChI

InChI=1S/C14H19N3O3S2/c1-11(18)12-3-5-13(6-4-12)22(19,20)17-9-7-16(8-10-17)14(21)15-2/h3-6H,7-10H2,1-2H3,(H,15,21)