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

Systemtic Name: 4-(4-ethanoylphenyl)sulfonyl-N-ethyl-piperazine-1-carbothioamide Openeye Name: 4-(4-acetylphenyl)sulfonyl-N-ethyl-piperazine-1-carbothioamide CAS Name: 4-(4-acetylphenyl)sulfonyl-N-ethyl-1-piperazinecarbothioamide IUPAC Name: 4-(4-acetylphenyl)sulfonyl-N-ethylpiperazine-1-carbothioamide Traditional Name: 4-(4-acetylphenyl)sulfonyl-N-ethyl-piperazine-1-carbothioamide Formula: C15H21N3O3S2 MolecularWeight: 355.47554

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)C

Isomeric SMILES

CCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)C

InChI

InChI=1S/C15H21N3O3S2/c1-3-16-15(22)17-8-10-18(11-9-17)23(20,21)14-6-4-13(5-7-14)12(2)19/h4-7H,3,8-11H2,1-2H3,(H,16,22)