N-[[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]carbamothioyl]hexanamide

Systemtic Name: N-[[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]carbamothioyl]hexanamide Openeye Name: N-[[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]carbamothioyl]hexanamide CAS Name: N-[[4-(4-ethyl-1-piperazin-4-iumyl)anilino]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]carbamothioyl]hexanamide Traditional Name: N-[[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]thiocarbamoyl]hexanamide Formula: C19H31N4OS+ MolecularWeight: 363.54064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=CC=C(C=C1)N2CC[NH+](CC2)CC

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=CC=C(C=C1)N2CC[NH+](CC2)CC

InChI

InChI=1S/C19H30N4OS/c1-3-5-6-7-18(24)21-19(25)20-16-8-10-17(11-9-16)23-14-12-22(4-2)13-15-23/h8-11H,3-7,12-15H2,1-2H3,(H2,20,21,24,25)/p+1