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

Systemtic Name: N-(2-methylprop-2-enyl)-4-[(E)-2-phenylethenyl]sulfonyl-piperazine-1-carbothioamide Openeye Name: N-(2-methylallyl)-4-[(E)-styryl]sulfonyl-piperazine-1-carbothioamide CAS Name: N-(2-methylprop-2-enyl)-4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-(2-methylprop-2-enyl)-4-[(E)-2-phenylethenyl]sulfonylpiperazine-1-carbothioamide Traditional Name: N-(2-methylallyl)-4-[(E)-styryl]sulfonyl-piperazine-1-carbothioamide Formula: C17H23N3O2S2 MolecularWeight: 365.51342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N3O2S2/c1-15(2)14-18-17(23)19-9-11-20(12-10-19)24(21,22)13-8-16-6-4-3-5-7-16/h3-8,13H,1,9-12,14H2,2H3,(H,18,23)/b13-8+