N-(3-morpholin-4-ium-4-ylpropyl)-4-(thiophen-3-ylmethyl)piperazin-4-ium-1-carbothioamide

Systemtic Name: N-(3-morpholin-4-ium-4-ylpropyl)-4-(thiophen-3-ylmethyl)piperazin-4-ium-1-carbothioamide Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-4-(3-thienylmethyl)piperazin-4-ium-1-carbothioamide CAS Name: N-[3-(4-morpholin-4-iumyl)propyl]-4-(3-thiophenylmethyl)-1-piperazin-4-iumcarbothioamide IUPAC Name: N-(3-morpholin-4-ium-4-ylpropyl)-4-(thiophen-3-ylmethyl)piperazin-4-ium-1-carbothioamide Traditional Name: N-(3-morpholin-4-ium-4-ylpropyl)-4-(3-thenyl)piperazin-4-ium-1-carbothioamide Formula: C17H30N4OS2+2 MolecularWeight: 370.5763

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CSC=C2)C(=S)NCCC[NH+]3CCOCC3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CSC=C2)C(=S)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C17H28N4OS2/c23-17(18-3-1-4-19-9-11-22-12-10-19)21-7-5-20(6-8-21)14-16-2-13-24-15-16/h2,13,15H,1,3-12,14H2,(H,18,23)/p+2