N-[3-(dimethylamino)propyl]-4-[(E)-2-phenylethenyl]sulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-[3-(dimethylamino)propyl]-4-[(E)-2-phenylethenyl]sulfonyl-piperazine-1-carbothioamide Openeye Name: N-[3-(dimethylamino)propyl]-4-[(E)-styryl]sulfonyl-piperazine-1-carbothioamide CAS Name: N-[3-(dimethylamino)propyl]-4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-[3-(dimethylamino)propyl]-4-[(E)-2-phenylethenyl]sulfonylpiperazine-1-carbothioamide Traditional Name: N-[3-(dimethylamino)propyl]-4-[(E)-styryl]sulfonyl-piperazine-1-carbothioamide Formula: C18H28N4O2S2 MolecularWeight: 396.57052

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC(=S)N1CCN(CC1)S(=O)(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CN(C)CCCNC(=S)N1CCN(CC1)S(=O)(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C18H28N4O2S2/c1-20(2)11-6-10-19-18(25)21-12-14-22(15-13-21)26(23,24)16-9-17-7-4-3-5-8-17/h3-5,7-9,16H,6,10-15H2,1-2H3,(H,19,25)/b16-9+