N,N-diethyl-4,6-bis(phenylmethoxy)-2-(4-phenylmethoxyphenyl)-1-benzothiophene-3-carboxamide

Systemtic Name: N,N-diethyl-4,6-bis(phenylmethoxy)-2-(4-phenylmethoxyphenyl)-1-benzothiophene-3-carboxamide Openeye Name: 4,6-dibenzyloxy-2-(4-benzyloxyphenyl)-N,N-diethyl-benzothiophene-3-carboxamide CAS Name: N,N-diethyl-4,6-bis(phenylmethoxy)-2-(4-phenylmethoxyphenyl)-1-benzothiophene-3-carboxamide IUPAC Name: N,N-diethyl-4,6-bis(phenylmethoxy)-2-(4-phenylmethoxyphenyl)-1-benzothiophene-3-carboxamide Traditional Name: 4,6-dibenzoxy-2-(4-benzoxyphenyl)-N,N-diethyl-benzothiophene-3-carboxamide Formula: C40H37NO4S MolecularWeight: 627.79108

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(SC2=CC(=CC(=C21)OCC3=CC=CC=C3)OCC4=CC=CC=C4)C5=CC=C(C=C5)OCC6=CC=CC=C6

Isomeric SMILES

CCN(CC)C(=O)C1=C(SC2=CC(=CC(=C21)OCC3=CC=CC=C3)OCC4=CC=CC=C4)C5=CC=C(C=C5)OCC6=CC=CC=C6

InChI

InChI=1S/C40H37NO4S/c1-3-41(4-2)40(42)38-37-35(45-28-31-18-12-7-13-19-31)24-34(44-27-30-16-10-6-11-17-30)25-36(37)46-39(38)32-20-22-33(23-21-32)43-26-29-14-8-5-9-15-29/h5-25H,3-4,26-28H2,1-2H3