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

Systemtic Name: 4-[(E)-2-phenylethenyl]sulfonyl-N-propyl-piperazine-1-carbothioamide Openeye Name: N-propyl-4-[(E)-styryl]sulfonyl-piperazine-1-carbothioamide CAS Name: 4-[(E)-2-phenylethenyl]sulfonyl-N-propyl-1-piperazinecarbothioamide IUPAC Name: 4-[(E)-2-phenylethenyl]sulfonyl-N-propylpiperazine-1-carbothioamide Traditional Name: N-propyl-4-[(E)-styryl]sulfonyl-piperazine-1-carbothioamide Formula: C16H23N3O2S2 MolecularWeight: 353.50272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23N3O2S2/c1-2-9-17-16(22)18-10-12-19(13-11-18)23(20,21)14-8-15-6-4-3-5-7-15/h3-8,14H,2,9-13H2,1H3,(H,17,22)/b14-8+