4-ethyl-2-(3-pyridin-3-ylpropyl)-8-(thiophen-3-ylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione

Systemtic Name: 4-ethyl-2-(3-pyridin-3-ylpropyl)-8-(thiophen-3-ylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Openeye Name: 4-ethyl-2-[3-(3-pyridyl)propyl]-8-(3-thienylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione CAS Name: 4-ethyl-2-[3-(3-pyridinyl)propyl]-8-(3-thiophenylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione IUPAC Name: 4-ethyl-2-(3-pyridin-3-ylpropyl)-8-(thiophen-3-ylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Traditional Name: 4-ethyl-2-[3-(3-pyridyl)propyl]-8-(3-thenyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-quinone Formula: C22H29N4O2S+ MolecularWeight: 413.55626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)N(C(=O)C12CC[NH+](CC2)CC3=CSC=C3)CCCC4=CN=CC=C4

Isomeric SMILES

CCN1C(=O)N(C(=O)C12CC[NH+](CC2)CC3=CSC=C3)CCCC4=CN=CC=C4

InChI

InChI=1S/C22H28N4O2S/c1-2-26-21(28)25(11-4-6-18-5-3-10-23-15-18)20(27)22(26)8-12-24(13-9-22)16-19-7-14-29-17-19/h3,5,7,10,14-15,17H,2,4,6,8-9,11-13,16H2,1H3/p+1