tert-butyl 5,6-bis(4-chlorophenyl)-3-(4-phenyl-1,3-oxazol-2-yl)pyrazine-2-carboxylate

Systemtic Name: tert-butyl 5,6-bis(4-chlorophenyl)-3-(4-phenyl-1,3-oxazol-2-yl)pyrazine-2-carboxylate Openeye Name: tert-butyl 5,6-bis(4-chlorophenyl)-3-(4-phenyloxazol-2-yl)pyrazine-2-carboxylate CAS Name: 5,6-bis(4-chlorophenyl)-3-(4-phenyl-2-oxazolyl)-2-pyrazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5,6-bis(4-chlorophenyl)-3-(4-phenyl-1,3-oxazol-2-yl)pyrazine-2-carboxylate Traditional Name: 5,6-bis(4-chlorophenyl)-3-(4-phenyloxazol-2-yl)pyrazinic acid tert-butyl ester Formula: C30H23Cl2N3O3 MolecularWeight: 544.42792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=NC(=C(N=C1C2=NC(=CO2)C3=CC=CC=C3)C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)Cl

Isomeric SMILES

CC(C)(C)OC(=O)C1=NC(=C(N=C1C2=NC(=CO2)C3=CC=CC=C3)C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C30H23Cl2N3O3/c1-30(2,3)38-29(36)27-26(28-33-23(17-37-28)18-7-5-4-6-8-18)34-24(19-9-13-21(31)14-10-19)25(35-27)20-11-15-22(32)16-12-20/h4-17H,1-3H3