N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-(4-methylsulfonylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-(4-methylsulfonylpiperazin-1-ium-1-yl)propanamide Openeye Name: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-(4-methylsulfonylpiperazin-1-ium-1-yl)propanamide CAS Name: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-(4-methylsulfonyl-1-piperazin-1-iumyl)propanamide IUPAC Name: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-(4-methylsulfonylpiperazin-1-ium-1-yl)propanamide Traditional Name: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-(4-mesylpiperazin-1-ium-1-yl)propionamide Formula: C16H23N4O3S2+ MolecularWeight: 383.50882

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC[NH+](CC1)CCC(=O)NC2=C(C3=C(S2)CCC3)C#N

Isomeric SMILES

CS(=O)(=O)N1CC[NH+](CC1)CCC(=O)NC2=C(C3=C(S2)CCC3)C#N

InChI

InChI=1S/C16H22N4O3S2/c1-25(22,23)20-9-7-19(8-10-20)6-5-15(21)18-16-13(11-17)12-3-2-4-14(12)24-16/h2-10H2,1H3,(H,18,21)/p+1