ethyl 3',3'-bis(4-chlorophenyl)-4-phenyl-spiro[1,3,4-thiadiazole-5,1'-2-benzothiophene]-2-carboxylate

Systemtic Name: ethyl 3',3'-bis(4-chlorophenyl)-4-phenyl-spiro[1,3,4-thiadiazole-5,1'-2-benzothiophene]-2-carboxylate Openeye Name: ethyl 3',3'-bis(4-chlorophenyl)-4-phenyl-spiro[1,3,4-thiadiazole-5,1'-2-benzothiophene]-2-carboxylate CAS Name: 3',3'-bis(4-chlorophenyl)-4-phenyl-2-spiro[1,3,4-thiadiazole-5,1'-2-benzothiophene]carboxylic acid ethyl ester IUPAC Name: ethyl 3',3'-bis(4-chlorophenyl)-4-phenylspiro[1,3,4-thiadiazole-5,1'-2-benzothiophene]-2-carboxylate Traditional Name: 3',3'-bis(4-chlorophenyl)-4-phenyl-spiro[1,3,4-thiadiazole-5,1'-isobenzothiophene]-2-carboxylic acid ethyl ester Formula: C30H22Cl2N2O2S2 MolecularWeight: 577.54388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C2(S1)C3=CC=CC=C3C(S2)(C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)Cl)C6=CC=CC=C6

Isomeric SMILES

CCOC(=O)C1=NN(C2(S1)C3=CC=CC=C3C(S2)(C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)Cl)C6=CC=CC=C6

InChI

InChI=1S/C30H22Cl2N2O2S2/c1-2-36-28(35)27-33-34(24-8-4-3-5-9-24)30(37-27)26-11-7-6-10-25(26)29(38-30,20-12-16-22(31)17-13-20)21-14-18-23(32)19-15-21/h3-19H,2H2,1H3