N-[1-methoxy-6-[5-(2-phenylethynyl)thiophen-2-yl]-6H-benzo[c]chromen-8-yl]methanesulfonamide

Systemtic Name: N-[1-methoxy-6-[5-(2-phenylethynyl)thiophen-2-yl]-6H-benzo[c]chromen-8-yl]methanesulfonamide Openeye Name: N-[1-methoxy-6-[5-(2-phenylethynyl)-2-thienyl]-6H-benzo[c]chromen-8-yl]methanesulfonamide CAS Name: N-[1-methoxy-6-[5-(2-phenylethynyl)-2-thiophenyl]-6H-benzo[c][1]benzopyran-8-yl]methanesulfonamide IUPAC Name: N-[1-methoxy-6-[5-(2-phenylethynyl)thiophen-2-yl]-6H-benzo[c]chromen-8-yl]methanesulfonamide Traditional Name: N-[1-methoxy-6-[5-(2-phenylethynyl)-2-thienyl]-6H-benzo[c]chromen-8-yl]methanesulfonamide Formula: C27H21NO4S2 MolecularWeight: 487.58994

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C3=C(C=C(C=C3)NS(=O)(=O)C)C(O2)C4=CC=C(S4)C#CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC2=C1C3=C(C=C(C=C3)NS(=O)(=O)C)C(O2)C4=CC=C(S4)C#CC5=CC=CC=C5

InChI

InChI=1S/C27H21NO4S2/c1-31-23-9-6-10-24-26(23)21-15-12-19(28-34(2,29)30)17-22(21)27(32-24)25-16-14-20(33-25)13-11-18-7-4-3-5-8-18/h3-10,12,14-17,27-28H,1-2H3