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

Systemtic Name: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-(4-phenethylpiperazin-4-ium-1-yl)propanamide Openeye Name: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-(4-phenethylpiperazin-4-ium-1-yl)propanamide CAS Name: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-(4-phenethyl-1-piperazin-4-iumyl)propanamide IUPAC Name: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-(4-phenethylpiperazin-4-ium-1-yl)propanamide Traditional Name: N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-3-(4-phenethylpiperazin-4-ium-1-yl)propionamide Formula: C23H29N4OS+ MolecularWeight: 409.56756

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)SC(=C2C#N)NC(=O)CCN3CC[NH+](CC3)CCC4=CC=CC=C4

Isomeric SMILES

C1CC2=C(C1)SC(=C2C#N)NC(=O)CCN3CC[NH+](CC3)CCC4=CC=CC=C4

InChI

InChI=1S/C23H28N4OS/c24-17-20-19-7-4-8-21(19)29-23(20)25-22(28)10-12-27-15-13-26(14-16-27)11-9-18-5-2-1-3-6-18/h1-3,5-6H,4,7-16H2,(H,25,28)/p+1