2-ethyl-4-phenethyl-8-(thian-4-yl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione

Systemtic Name: 2-ethyl-4-phenethyl-8-(thian-4-yl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Openeye Name: 2-ethyl-4-phenethyl-8-tetrahydrothiopyran-4-yl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione CAS Name: 2-ethyl-4-phenethyl-8-(4-thianyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione IUPAC Name: 2-ethyl-4-phenethyl-8-(thian-4-yl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Traditional Name: 2-ethyl-4-phenethyl-8-tetrahydrothiopyran-4-yl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-quinone Formula: C22H32N3O2S+ MolecularWeight: 402.57338

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2(CC[NH+](CC2)C3CCSCC3)N(C1=O)CCC4=CC=CC=C4

Isomeric SMILES

CCN1C(=O)C2(CC[NH+](CC2)C3CCSCC3)N(C1=O)CCC4=CC=CC=C4

InChI

InChI=1S/C22H31N3O2S/c1-2-24-20(26)22(11-14-23(15-12-22)19-9-16-28-17-10-19)25(21(24)27)13-8-18-6-4-3-5-7-18/h3-7,19H,2,8-17H2,1H3/p+1