[4-[(3-cyclopentyl-4,5-dimethyl-2-sulfanylidene-imidazol-1-yl)methyl]piperazin-4-ium-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [4-[(3-cyclopentyl-4,5-dimethyl-2-sulfanylidene-imidazol-1-yl)methyl]piperazin-4-ium-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-[(3-cyclopentyl-4,5-dimethyl-2-thioxo-imidazol-1-yl)methyl]piperazin-4-ium-1-yl]-(2-thienyl)methanone CAS Name: [4-[(3-cyclopentyl-4,5-dimethyl-2-sulfanylidene-1-imidazolyl)methyl]-1-piperazin-4-iumyl]-thiophen-2-ylmethanone IUPAC Name: [4-[(3-cyclopentyl-4,5-dimethyl-2-sulfanylideneimidazol-1-yl)methyl]piperazin-4-ium-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-[(3-cyclopentyl-4,5-dimethyl-2-thioxo-4-imidazolin-1-yl)methyl]piperazin-4-ium-1-yl]-(2-thienyl)methanone Formula: C20H29N4OS2+ MolecularWeight: 405.60046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=S)N1C[NH+]2CCN(CC2)C(=O)C3=CC=CS3)C4CCCC4)C

Isomeric SMILES

CC1=C(N(C(=S)N1C[NH+]2CCN(CC2)C(=O)C3=CC=CS3)C4CCCC4)C

InChI

InChI=1S/C20H28N4OS2/c1-15-16(2)24(17-6-3-4-7-17)20(26)23(15)14-21-9-11-22(12-10-21)19(25)18-8-5-13-27-18/h5,8,13,17H,3-4,6-7,9-12,14H2,1-2H3/p+1