ditert-butyl 7-methyl-7-oxidanyl-9-phenyl-2-sulfanylidene-1,3,4-triazaspiro[4.5]decane-8,10-dicarboxylate

Systemtic Name: ditert-butyl 7-methyl-7-oxidanyl-9-phenyl-2-sulfanylidene-1,3,4-triazaspiro[4.5]decane-8,10-dicarboxylate Openeye Name: ditert-butyl 7-hydroxy-7-methyl-9-phenyl-2-thioxo-1,3,4-triazaspiro[4.5]decane-8,10-dicarboxylate CAS Name: 7-hydroxy-7-methyl-9-phenyl-2-sulfanylidene-1,3,4-triazaspiro[4.5]decane-8,10-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 7-hydroxy-7-methyl-9-phenyl-2-sulfanylidene-1,3,4-triazaspiro[4.5]decane-8,10-dicarboxylate Traditional Name: 7-hydroxy-7-methyl-9-phenyl-2-thioxo-1,3,4-triazaspiro[4.5]decane-8,10-dicarboxylic acid ditert-butyl ester Formula: C24H35N3O5S MolecularWeight: 477.6168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2(C(C(C1C(=O)OC(C)(C)C)C3=CC=CC=C3)C(=O)OC(C)(C)C)NC(=S)NN2)O

Isomeric SMILES

CC1(CC2(C(C(C1C(=O)OC(C)(C)C)C3=CC=CC=C3)C(=O)OC(C)(C)C)NC(=S)NN2)O

InChI

InChI=1S/C24H35N3O5S/c1-21(2,3)31-18(28)16-15(14-11-9-8-10-12-14)17(19(29)32-22(4,5)6)24(13-23(16,7)30)25-20(33)26-27-24/h8-12,15-17,27,30H,13H2,1-7H3,(H2,25,26,33)