N-tert-butyl-2-[4-[(3-cyclopentyl-4,5-dimethyl-2-sulfanylidene-imidazol-1-yl)methyl]piperazine-1,4-diium-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[(3-cyclopentyl-4,5-dimethyl-2-sulfanylidene-imidazol-1-yl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[(3-cyclopentyl-4,5-dimethyl-2-thioxo-imidazol-1-yl)methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[(3-cyclopentyl-4,5-dimethyl-2-sulfanylidene-1-imidazolyl)methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[(3-cyclopentyl-4,5-dimethyl-2-sulfanylideneimidazol-1-yl)methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[(3-cyclopentyl-4,5-dimethyl-2-thioxo-4-imidazolin-1-yl)methyl]piperazine-1,4-diium-1-yl]acetamide Formula: C21H39N5OS+2 MolecularWeight: 409.63226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=S)N1C[NH+]2CC[NH+](CC2)CC(=O)NC(C)(C)C)C3CCCC3)C

Isomeric SMILES

CC1=C(N(C(=S)N1C[NH+]2CC[NH+](CC2)CC(=O)NC(C)(C)C)C3CCCC3)C

InChI

InChI=1S/C21H37N5OS/c1-16-17(2)26(18-8-6-7-9-18)20(28)25(16)15-24-12-10-23(11-13-24)14-19(27)22-21(3,4)5/h18H,6-15H2,1-5H3,(H,22,27)/p+2