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

Systemtic Name: N-[[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]carbamothioyl]butanamide Openeye Name: N-[[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]carbamothioyl]butanamide CAS Name: N-[[4-(4-ethyl-1-piperazin-4-iumyl)anilino]-sulfanylidenemethyl]butanamide IUPAC Name: N-[[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]carbamothioyl]butanamide Traditional Name: N-[[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]thiocarbamoyl]butyramide Formula: C17H27N4OS+ MolecularWeight: 335.48748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N4OS/c1-3-5-16(22)19-17(23)18-14-6-8-15(9-7-14)21-12-10-20(4-2)11-13-21/h6-9H,3-5,10-13H2,1-2H3,(H2,18,19,22,23)/p+1