(2S,5S)-7-(3-chlorophenyl)-N-[(2S)-1-cyclobutyl-4-(dimethylamino)-3,4-bis(oxidanylidene)butan-2-yl]-3-[(2S)-2-(2-cyclohexylethanoylamino)-3,3-dimethyl-butanoyl]-9-oxa-3,8-diazaspiro[4.4]non-7-ene-2-carboxamide

Systemtic Name: (2S,5S)-7-(3-chlorophenyl)-N-[(2S)-1-cyclobutyl-4-(dimethylamino)-3,4-bis(oxidanylidene)butan-2-yl]-3-[(2S)-2-(2-cyclohexylethanoylamino)-3,3-dimethyl-butanoyl]-9-oxa-3,8-diazaspiro[4.4]non-7-ene-2-carboxamide Openeye Name: (2S,5S)-7-(3-chlorophenyl)-N-[(1S)-1-(cyclobutylmethyl)-3-(dimethylamino)-2,3-dioxo-propyl]-3-[(2S)-2-[(2-cyclohexylacetyl)amino]-3,3-dimethyl-butanoyl]-9-oxa-3,8-diazaspiro[4.4]non-7-ene-2-carboxamide CAS Name: (2S,5S)-7-(3-chlorophenyl)-N-[(2S)-1-cyclobutyl-4-(dimethylamino)-3,4-dioxobutan-2-yl]-3-[(2S)-2-[(2-cyclohexyl-1-oxoethyl)amino]-3,3-dimethyl-1-oxobutyl]-9-oxa-3,8-diazaspiro[4.4]non-7-ene-2-carboxamide IUPAC Name: (2S,5S)-7-(3-chlorophenyl)-N-[(2S)-1-cyclobutyl-4-(dimethylamino)-3,4-dioxobutan-2-yl]-3-[(2S)-2-[(2-cyclohexylacetyl)amino]-3,3-dimethylbutanoyl]-9-oxa-3,8-diazaspiro[4.4]non-7-ene-2-carboxamide Traditional Name: (2S,5S)-7-(3-chlorophenyl)-N-[(1S)-1-(cyclobutylmethyl)-3-(dimethylamino)-2,3-diketo-propyl]-3-[(2S)-2-[(2-cyclohexylacetyl)amino]-3,3-dimethyl-butanoyl]-9-oxa-3,8-diazaspiro[4.4]non-7-ene-2-carboxamide Formula: C37H52ClN5O6 MolecularWeight: 698.29168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)N1CC2(CC1C(=O)NC(CC3CCC3)C(=O)C(=O)N(C)C)CC(=NO2)C4=CC(=CC=C4)Cl)NC(=O)CC5CCCCC5

Isomeric SMILES

CC(C)(C)[C@@H](C(=O)N1C[C@]2(C[C@H]1C(=O)N[C@@H](CC3CCC3)C(=O)C(=O)N(C)C)CC(=NO2)C4=CC(=CC=C4)Cl)NC(=O)CC5CCCCC5

InChI

InChI=1S/C37H52ClN5O6/c1-36(2,3)32(40-30(44)18-24-11-7-6-8-12-24)35(48)43-22-37(20-28(41-49-37)25-15-10-16-26(38)19-25)21-29(43)33(46)39-27(17-23-13-9-14-23)31(45)34(47)42(4)5/h10,15-16,19,23-24,27,29,32H,6-9,11-14,17-18,20-22H2,1-5H3,(H,39,46)(H,40,44)/t27-,29-,32+,37+/m0/s1