N-(3-ethoxypropyl)-4-(2,3,5,6-tetramethylphenyl)sulfonyl-piperazine-1-carbothioamide

Systemtic Name: N-(3-ethoxypropyl)-4-(2,3,5,6-tetramethylphenyl)sulfonyl-piperazine-1-carbothioamide Openeye Name: N-(3-ethoxypropyl)-4-(2,3,5,6-tetramethylphenyl)sulfonyl-piperazine-1-carbothioamide CAS Name: N-(3-ethoxypropyl)-4-(2,3,5,6-tetramethylphenyl)sulfonyl-1-piperazinecarbothioamide IUPAC Name: N-(3-ethoxypropyl)-4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazine-1-carbothioamide Traditional Name: N-(3-ethoxypropyl)-4-(2,3,5,6-tetramethylphenyl)sulfonyl-piperazine-1-carbothioamide Formula: C20H33N3O3S2 MolecularWeight: 427.62432

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=C(C(=CC(=C2C)C)C)C

Isomeric SMILES

CCOCCCNC(=S)N1CCN(CC1)S(=O)(=O)C2=C(C(=CC(=C2C)C)C)C

InChI

InChI=1S/C20H33N3O3S2/c1-6-26-13-7-8-21-20(27)22-9-11-23(12-10-22)28(24,25)19-17(4)15(2)14-16(3)18(19)5/h14H,6-13H2,1-5H3,(H,21,27)