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

Systemtic Name: 4-(2,3,4,5,6-pentamethylphenyl)sulfonyl-N-prop-2-enyl-piperazine-1-carbothioamide Openeye Name: N-allyl-4-(2,3,4,5,6-pentamethylphenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: 4-(2,3,4,5,6-pentamethylphenyl)sulfonyl-N-prop-2-enyl-1-piperazinecarbothioamide IUPAC Name: 4-(2,3,4,5,6-pentamethylphenyl)sulfonyl-N-prop-2-enylpiperazine-1-carbothioamide Traditional Name: N-allyl-4-(2,3,4,5,6-pentamethylphenyl)sulfonyl-piperazine-1-carbothioamide Formula: C19H29N3O2S2 MolecularWeight: 395.58246

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H29N3O2S2/c1-7-8-20-19(25)21-9-11-22(12-10-21)26(23,24)18-16(5)14(3)13(2)15(4)17(18)6/h7H,1,8-12H2,2-6H3,(H,20,25)