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

Systemtic Name: N-[[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]carbamothioyl]pentanamide Openeye Name: N-[[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]carbamothioyl]pentanamide CAS Name: N-[[4-(4-ethyl-1-piperazin-4-iumyl)anilino]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]carbamothioyl]pentanamide Traditional Name: N-[[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]thiocarbamoyl]valeramide Formula: C18H29N4OS+ MolecularWeight: 349.51406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28N4OS/c1-3-5-6-17(23)20-18(24)19-15-7-9-16(10-8-15)22-13-11-21(4-2)12-14-22/h7-10H,3-6,11-14H2,1-2H3,(H2,19,20,23,24)/p+1