N-phenethyl-8-(3,5,5-trimethylhexanoyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide

Systemtic Name: N-phenethyl-8-(3,5,5-trimethylhexanoyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Openeye Name: N-phenethyl-8-(3,5,5-trimethylhexanoyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide CAS Name: N-phenethyl-8-(3,5,5-trimethyl-1-oxohexyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide IUPAC Name: N-phenethyl-8-(3,5,5-trimethylhexanoyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Traditional Name: N-phenethyl-8-(3,5,5-trimethylhexanoyl)-4-thia-1,8-diazaspiro[4.5]decane-2-carboxamide Formula: C25H39N3O2S MolecularWeight: 445.66106

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)N1CCC2(CC1)NC(CS2)C(=O)NCCC3=CC=CC=C3)CC(C)(C)C

Isomeric SMILES

CC(CC(=O)N1CCC2(CC1)NC(CS2)C(=O)NCCC3=CC=CC=C3)CC(C)(C)C

InChI

InChI=1S/C25H39N3O2S/c1-19(17-24(2,3)4)16-22(29)28-14-11-25(12-15-28)27-21(18-31-25)23(30)26-13-10-20-8-6-5-7-9-20/h5-9,19,21,27H,10-18H2,1-4H3,(H,26,30)