11-(2-tert-butylsulfanylethyl)-9-(2-methylpropyl)-3-(6-phenylhexyl)-3,8,11-triazaspiro[5.5]undecane-7,10-dione

Systemtic Name: 11-(2-tert-butylsulfanylethyl)-9-(2-methylpropyl)-3-(6-phenylhexyl)-3,8,11-triazaspiro[5.5]undecane-7,10-dione Openeye Name: 11-(2-tert-butylsulfanylethyl)-9-isobutyl-3-(6-phenylhexyl)-3,8,11-triazaspiro[5.5]undecane-7,10-dione CAS Name: 11-[2-(tert-butylthio)ethyl]-9-(2-methylpropyl)-3-(6-phenylhexyl)-3,8,11-triazaspiro[5.5]undecane-7,10-dione IUPAC Name: 11-(2-tert-butylsulfanylethyl)-9-(2-methylpropyl)-3-(6-phenylhexyl)-3,8,11-triazaspiro[5.5]undecane-7,10-dione Traditional Name: 11-[2-(tert-butylthio)ethyl]-9-isobutyl-3-(6-phenylhexyl)-3,8,11-triazaspiro[5.5]undecane-7,10-quinone Formula: C30H49N3O2S MolecularWeight: 515.79396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C(=O)N(C2(CCN(CC2)CCCCCCC3=CC=CC=C3)C(=O)N1)CCSC(C)(C)C

Isomeric SMILES

CC(C)CC1C(=O)N(C2(CCN(CC2)CCCCCCC3=CC=CC=C3)C(=O)N1)CCSC(C)(C)C

InChI

InChI=1S/C30H49N3O2S/c1-24(2)23-26-27(34)33(21-22-36-29(3,4)5)30(28(35)31-26)16-19-32(20-17-30)18-12-7-6-9-13-25-14-10-8-11-15-25/h8,10-11,14-15,24,26H,6-7,9,12-13,16-23H2,1-5H3,(H,31,35)