N-(2-methylprop-2-enyl)-4-(2,3,4,5,6-pentamethylphenyl)sulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-(2-methylprop-2-enyl)-4-(2,3,4,5,6-pentamethylphenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: N-(2-methylallyl)-4-(2,3,4,5,6-pentamethylphenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: N-(2-methylprop-2-enyl)-4-(2,3,4,5,6-pentamethylphenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-(2-methylprop-2-enyl)-4-(2,3,4,5,6-pentamethylphenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-(2-methylallyl)-4-(2,3,4,5,6-pentamethylphenyl)sulfonyl-piperazine-1-carbothioamide Formula: C20H31N3O2S2 MolecularWeight: 409.60904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)N2CCN(CC2)C(=S)NCC(=C)C)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)N2CCN(CC2)C(=S)NCC(=C)C)C)C

InChI

InChI=1S/C20H31N3O2S2/c1-13(2)12-21-20(26)22-8-10-23(11-9-22)27(24,25)19-17(6)15(4)14(3)16(5)18(19)7/h1,8-12H2,2-7H3,(H,21,26)