dimethyl 6,7-ditert-butyl-4-phenyl-1-sulfanylidene-7-aza-1$l^{5}-phosphabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylate

Systemtic Name: dimethyl 6,7-ditert-butyl-4-phenyl-1-sulfanylidene-7-aza-1$l^{5}-phosphabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylate Openeye Name: dimethyl 6,7-ditert-butyl-4-phenyl-1-thioxo-7-aza-1$l^{5}-phosphabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylate CAS Name: 6,7-ditert-butyl-4-phenyl-1-sulfanylidene-7-aza-1$l^{5}-phosphabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 6,7-ditert-butyl-4-phenyl-1-sulfanylidene-7-aza-1$l^{5}-phosphabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylate Traditional Name: 6,7-ditert-butyl-4-phenyl-1-thioxo-7-aza-1$l^{5}-phosphabicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylic acid dimethyl ester Formula: C23H30NO4PS MolecularWeight: 447.527361

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2(C(=C(P1(=S)N2C(C)(C)C)C(=O)OC)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC2(C(=C(P1(=S)N2C(C)(C)C)C(=O)OC)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C23H30NO4PS/c1-21(2,3)16-14-23(15-12-10-9-11-13-15)17(19(25)27-7)18(20(26)28-8)29(16,30)24(23)22(4,5)6/h9-14H,1-8H3